(1S,5R)-6-[(4-fluorophenyl)methyl]-7-(4-phenylphenyl)-3,6-diazabicyclo[3.1.1]heptane (Q27220269)

BRD-K34812979-001-01-8 (English)

11 October 2016

chemical formula

C₂₄H₂₃FN₂

1 reference

BRD-K34812979-001-01-8 (English)

11 October 2016

canonical SMILES

C1C2C(C(N2CC3=CC=C(C=C3)F)CN1)C4=CC=C(C=C4)C5=CC=CC=C5

1 reference

BRD-K34812979-001-01-8 (English)

11 October 2016

isomeric SMILES

C1[C@@H]2C([C@@H](N2CC3=CC=C(C=C3)F)CN1)C4=CC=C(C=C4)C5=CC=CC=C5

1 reference

BRD-K34812979-001-01-8 (English)

InChI=1S/C24H23FN2/c25-21-12-6-17(7-13-21)16-27-22-14-26-15-23(27)24(22)20-10-8-19(9-11-20)18-4-2-1-3-5-18/h1-13,22-24,26H,14-16H2/t22-,23+,24?

11 October 2016

Identifiers

InChI

1 reference

BRD-K34812979-001-01-8 (English)

LOASXRAPWWMBQD-VSGJHWFKSA-N

11 October 2016

InChIKey

2 references

BRD-K34812979-001-01-8 (English)

11 October 2016

stated in

ChEBI release 2020-09-01

2 references

BRD-K34812979-001-01-8 (English)

matched by identifier from

11 October 2016

InChIKey

LOASXRAPWWMBQD-VSGJHWFKSA-N

ChEBI ID

127617

mapping relation type

2 references

(1S,5R)-6-[(4-fluorophenyl)methyl]-7-(4-phenylphenyl)-3,6-diazabicyclo[3.1.1]heptane (English)