(2S)-2-azanyl-4-[(4-phenylmethoxyphenyl)methylamino]-1-piperidin-1-yl-butan-1-one

Systemtic Name: (2S)-2-azanyl-4-[(4-phenylmethoxyphenyl)methylamino]-1-piperidin-1-yl-butan-1-one Openeye Name: (2S)-2-amino-4-[(4-benzyloxyphenyl)methylamino]-1-(1-piperidyl)butan-1-one CAS Name: (2S)-2-amino-4-[(4-phenylmethoxyphenyl)methylamino]-1-(1-piperidinyl)-1-butanone IUPAC Name: (2S)-2-amino-4-[(4-phenylmethoxyphenyl)methylamino]-1-piperidin-1-ylbutan-1-one Traditional Name: (2S)-2-amino-4-[(4-benzoxybenzyl)amino]-1-piperidino-butan-1-one Formula: C23H31N3O2 MolecularWeight: 381.51114

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)C(CCNCC2=CC=C(C=C2)OCC3=CC=CC=C3)N

Isomeric SMILES

C1CCN(CC1)C(=O)[C@H](CCNCC2=CC=C(C=C2)OCC3=CC=CC=C3)N

InChI

InChI=1S/C23H31N3O2/c24-22(23(27)26-15-5-2-6-16-26)13-14-25-17-19-9-11-21(12-10-19)28-18-20-7-3-1-4-8-20/h1,3-4,7-12,22,25H,2,5-6,13-18,24H2/t22-/m0/s1