pentyl 3-(3-methylphenyl)carbonyl-5,6,7,8-tetrahydroindolizine-8-carboxylate

Systemtic Name: pentyl 3-(3-methylphenyl)carbonyl-5,6,7,8-tetrahydroindolizine-8-carboxylate Openeye Name: pentyl 3-(3-methylbenzoyl)-5,6,7,8-tetrahydroindolizine-8-carboxylate CAS Name: 3-[(3-methylphenyl)-oxomethyl]-5,6,7,8-tetrahydroindolizine-8-carboxylic acid pentyl ester IUPAC Name: pentyl 3-(3-methylbenzoyl)-5,6,7,8-tetrahydroindolizine-8-carboxylate Traditional Name: 3-m-toluoyl-5,6,7,8-tetrahydroindolizine-8-carboxylic acid amyl ester Formula: C22H27NO3 MolecularWeight: 353.45468

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC(=O)C1CCCN2C1=CC=C2C(=O)C3=CC(=CC=C3)C

Isomeric SMILES

CCCCCOC(=O)C1CCCN2C1=CC=C2C(=O)C3=CC(=CC=C3)C

InChI

InChI=1S/C22H27NO3/c1-3-4-5-14-26-22(25)18-10-7-13-23-19(18)11-12-20(23)21(24)17-9-6-8-16(2)15-17/h6,8-9,11-12,15,18H,3-5,7,10,13-14H2,1-2H3