2-methyl-5-oxidanyl-N-(1-phenethylazepan-4-yl)-1-(phenylmethyl)indole-3-carboxamide

Systemtic Name: 2-methyl-5-oxidanyl-N-(1-phenethylazepan-4-yl)-1-(phenylmethyl)indole-3-carboxamide Openeye Name: 1-benzyl-5-hydroxy-2-methyl-N-(1-phenethylazepan-4-yl)indole-3-carboxamide CAS Name: 5-hydroxy-2-methyl-N-(1-phenethyl-4-azepanyl)-1-(phenylmethyl)-3-indolecarboxamide IUPAC Name: 1-benzyl-5-hydroxy-2-methyl-N-(1-phenethylazepan-4-yl)indole-3-carboxamide Traditional Name: 1-benzyl-5-hydroxy-2-methyl-N-(1-phenethylazepan-4-yl)indole-3-carboxamide Formula: C31H35N3O2 MolecularWeight: 481.6285

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(N1CC3=CC=CC=C3)C=CC(=C2)O)C(=O)NC4CCCN(CC4)CCC5=CC=CC=C5

Isomeric SMILES

CC1=C(C2=C(N1CC3=CC=CC=C3)C=CC(=C2)O)C(=O)NC4CCCN(CC4)CCC5=CC=CC=C5

InChI

InChI=1S/C31H35N3O2/c1-23-30(28-21-27(35)14-15-29(28)34(23)22-25-11-6-3-7-12-25)31(36)32-26-13-8-18-33(20-17-26)19-16-24-9-4-2-5-10-24/h2-7,9-12,14-15,21,26,35H,8,13,16-20,22H2,1H3,(H,32,36)