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

Systemtic Name: 3-methylbutyl 3-(phenylcarbonyl)-5,6,7,8-tetrahydroindolizine-8-carboxylate Openeye Name: isopentyl 3-benzoyl-5,6,7,8-tetrahydroindolizine-8-carboxylate CAS Name: 3-benzoyl-5,6,7,8-tetrahydroindolizine-8-carboxylic acid 3-methylbutyl ester IUPAC Name: 3-methylbutyl 3-benzoyl-5,6,7,8-tetrahydroindolizine-8-carboxylate Traditional Name: 3-benzoyl-5,6,7,8-tetrahydroindolizine-8-carboxylic acid isoamyl ester Formula: C21H25NO3 MolecularWeight: 339.4281

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H25NO3/c1-15(2)12-14-25-21(24)17-9-6-13-22-18(17)10-11-19(22)20(23)16-7-4-3-5-8-16/h3-5,7-8,10-11,15,17H,6,9,12-14H2,1-2H3