[1-butyl-2-methyl-3-[(1-phenethylpiperidin-4-yl)carbamoyl]indol-5-yl] ethanoate hydrochloride

Systemtic Name: [1-butyl-2-methyl-3-[(1-phenethylpiperidin-4-yl)carbamoyl]indol-5-yl] ethanoate hydrochloride Openeye Name: [1-butyl-2-methyl-3-[(1-phenethyl-4-piperidyl)carbamoyl]indol-5-yl] acetate hydrochloride CAS Name: acetic acid [1-butyl-2-methyl-3-[oxo-[(1-phenethyl-4-piperidinyl)amino]methyl]-5-indolyl] ester hydrochloride IUPAC Name: [1-butyl-2-methyl-3-[(1-phenethylpiperidin-4-yl)carbamoyl]indol-5-yl] acetate hydrochloride Traditional Name: acetic acid [1-butyl-2-methyl-3-[(1-phenethyl-4-piperidyl)carbamoyl]indol-5-yl] ester hydrochloride Formula: C29H38ClN3O3 MolecularWeight: 512.08332

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C29H37N3O3.ClH/c1-4-5-16-32-21(2)28(26-20-25(35-22(3)33)11-12-27(26)32)29(34)30-24-14-18-31(19-15-24)17-13-23-9-7-6-8-10-23;/h6-12,20,24H,4-5,13-19H2,1-3H3,(H,30,34);1H