3-methylbutyl 3-(3-chlorophenyl)carbonyl-5,6,7,8-tetrahydroindolizine-8-carboxylate

Systemtic Name: 3-methylbutyl 3-(3-chlorophenyl)carbonyl-5,6,7,8-tetrahydroindolizine-8-carboxylate Openeye Name: isopentyl 3-(3-chlorobenzoyl)-5,6,7,8-tetrahydroindolizine-8-carboxylate CAS Name: 3-[(3-chlorophenyl)-oxomethyl]-5,6,7,8-tetrahydroindolizine-8-carboxylic acid 3-methylbutyl ester IUPAC Name: 3-methylbutyl 3-(3-chlorobenzoyl)-5,6,7,8-tetrahydroindolizine-8-carboxylate Traditional Name: 3-(3-chlorobenzoyl)-5,6,7,8-tetrahydroindolizine-8-carboxylic acid isoamyl ester Formula: C21H24ClNO3 MolecularWeight: 373.87316

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC(=O)C1CCCN2C1=CC=C2C(=O)C3=CC(=CC=C3)Cl

Isomeric SMILES

CC(C)CCOC(=O)C1CCCN2C1=CC=C2C(=O)C3=CC(=CC=C3)Cl

InChI

InChI=1S/C21H24ClNO3/c1-14(2)10-12-26-21(25)17-7-4-11-23-18(17)8-9-19(23)20(24)15-5-3-6-16(22)13-15/h3,5-6,8-9,13-14,17H,4,7,10-12H2,1-2H3