N-[3-[4-[(3,4-dimethoxyphenyl)methylamino]piperidin-1-yl]phenyl]-4-phenyl-butanamide

Systemtic Name: N-[3-[4-[(3,4-dimethoxyphenyl)methylamino]piperidin-1-yl]phenyl]-4-phenyl-butanamide Openeye Name: N-[3-[4-[(3,4-dimethoxyphenyl)methylamino]-1-piperidyl]phenyl]-4-phenyl-butanamide CAS Name: N-[3-[4-[(3,4-dimethoxyphenyl)methylamino]-1-piperidinyl]phenyl]-4-phenylbutanamide IUPAC Name: N-[3-[4-[(3,4-dimethoxyphenyl)methylamino]piperidin-1-yl]phenyl]-4-phenylbutanamide Traditional Name: 4-phenyl-N-[3-[4-(veratrylamino)piperidino]phenyl]butyramide Formula: C30H37N3O3 MolecularWeight: 487.63308

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CNC2CCN(CC2)C3=CC(=CC=C3)NC(=O)CCCC4=CC=CC=C4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CNC2CCN(CC2)C3=CC(=CC=C3)NC(=O)CCCC4=CC=CC=C4)OC

InChI

InChI=1S/C30H37N3O3/c1-35-28-15-14-24(20-29(28)36-2)22-31-25-16-18-33(19-17-25)27-12-7-11-26(21-27)32-30(34)13-6-10-23-8-4-3-5-9-23/h3-5,7-9,11-12,14-15,20-21,25,31H,6,10,13,16-19,22H2,1-2H3,(H,32,34)