1-butyl-2-methyl-5-oxidanyl-N-(1-phenethylpiperidin-4-yl)indole-3-carboxamide hydrochloride

Systemtic Name: 1-butyl-2-methyl-5-oxidanyl-N-(1-phenethylpiperidin-4-yl)indole-3-carboxamide hydrochloride Openeye Name: 1-butyl-5-hydroxy-2-methyl-N-(1-phenethyl-4-piperidyl)indole-3-carboxamide hydrochloride CAS Name: 1-butyl-5-hydroxy-2-methyl-N-(1-phenethyl-4-piperidinyl)-3-indolecarboxamide hydrochloride IUPAC Name: 1-butyl-5-hydroxy-2-methyl-N-(1-phenethylpiperidin-4-yl)indole-3-carboxamide hydrochloride Traditional Name: 1-butyl-5-hydroxy-2-methyl-N-(1-phenethyl-4-piperidyl)indole-3-carboxamide hydrochloride Formula: C27H36ClN3O2 MolecularWeight: 470.04664

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C2=C1C=CC(=C2)O)C(=O)NC3CCN(CC3)CCC4=CC=CC=C4)C.Cl

Isomeric SMILES

CCCCN1C(=C(C2=C1C=CC(=C2)O)C(=O)NC3CCN(CC3)CCC4=CC=CC=C4)C.Cl

InChI

InChI=1S/C27H35N3O2.ClH/c1-3-4-15-30-20(2)26(24-19-23(31)10-11-25(24)30)27(32)28-22-13-17-29(18-14-22)16-12-21-8-6-5-7-9-21;/h5-11,19,22,31H,3-4,12-18H2,1-2H3,(H,28,32);1H