2,7-dimethyl-5-oxidanyl-N-(1-phenethylpiperidin-4-yl)-1-(phenylmethyl)indole-3-carboxamide

Systemtic Name: 2,7-dimethyl-5-oxidanyl-N-(1-phenethylpiperidin-4-yl)-1-(phenylmethyl)indole-3-carboxamide Openeye Name: 1-benzyl-5-hydroxy-2,7-dimethyl-N-(1-phenethyl-4-piperidyl)indole-3-carboxamide CAS Name: 5-hydroxy-2,7-dimethyl-N-(1-phenethyl-4-piperidinyl)-1-(phenylmethyl)-3-indolecarboxamide IUPAC Name: 1-benzyl-5-hydroxy-2,7-dimethyl-N-(1-phenethylpiperidin-4-yl)indole-3-carboxamide Traditional Name: 1-benzyl-5-hydroxy-2,7-dimethyl-N-(1-phenethyl-4-piperidyl)indole-3-carboxamide Formula: C31H35N3O2 MolecularWeight: 481.6285

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC(=C1)O)C(=C(N2CC3=CC=CC=C3)C)C(=O)NC4CCN(CC4)CCC5=CC=CC=C5

Isomeric SMILES

CC1=C2C(=CC(=C1)O)C(=C(N2CC3=CC=CC=C3)C)C(=O)NC4CCN(CC4)CCC5=CC=CC=C5

InChI

InChI=1S/C31H35N3O2/c1-22-19-27(35)20-28-29(23(2)34(30(22)28)21-25-11-7-4-8-12-25)31(36)32-26-14-17-33(18-15-26)16-13-24-9-5-3-6-10-24/h3-12,19-20,26,35H,13-18,21H2,1-2H3,(H,32,36)