hexyl 3-(4-ethylphenyl)carbonyl-2-methyl-5,6,7,8-tetrahydroindolizine-8-carboxylate

Systemtic Name: hexyl 3-(4-ethylphenyl)carbonyl-2-methyl-5,6,7,8-tetrahydroindolizine-8-carboxylate Openeye Name: hexyl 3-(4-ethylbenzoyl)-2-methyl-5,6,7,8-tetrahydroindolizine-8-carboxylate CAS Name: 3-[(4-ethylphenyl)-oxomethyl]-2-methyl-5,6,7,8-tetrahydroindolizine-8-carboxylic acid hexyl ester IUPAC Name: hexyl 3-(4-ethylbenzoyl)-2-methyl-5,6,7,8-tetrahydroindolizine-8-carboxylate Traditional Name: 3-(4-ethylbenzoyl)-2-methyl-5,6,7,8-tetrahydroindolizine-8-carboxylic acid hexyl ester Formula: C25H33NO3 MolecularWeight: 395.53442

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H33NO3/c1-4-6-7-8-16-29-25(28)21-10-9-15-26-22(21)17-18(3)23(26)24(27)20-13-11-19(5-2)12-14-20/h11-14,17,21H,4-10,15-16H2,1-3H3