4-phenylbutyl 1-[2-oxidanylidene-2-(3,4,5-trimethoxyphenyl)ethanoyl]piperidine-2-carboxylate

Systemtic Name: 4-phenylbutyl 1-[2-oxidanylidene-2-(3,4,5-trimethoxyphenyl)ethanoyl]piperidine-2-carboxylate Openeye Name: 4-phenylbutyl 1-[2-oxo-2-(3,4,5-trimethoxyphenyl)acetyl]piperidine-2-carboxylate CAS Name: 1-[1,2-dioxo-2-(3,4,5-trimethoxyphenyl)ethyl]-2-piperidinecarboxylic acid 4-phenylbutyl ester IUPAC Name: 4-phenylbutyl 1-[2-oxo-2-(3,4,5-trimethoxyphenyl)acetyl]piperidine-2-carboxylate Traditional Name: 1-[2-keto-2-(3,4,5-trimethoxyphenyl)acetyl]pipecolinic acid 4-phenylbutyl ester Formula: C27H33NO7 MolecularWeight: 483.55342

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C(=O)C(=O)N2CCCCC2C(=O)OCCCCC3=CC=CC=C3

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C(=O)C(=O)N2CCCCC2C(=O)OCCCCC3=CC=CC=C3

InChI

InChI=1S/C27H33NO7/c1-32-22-17-20(18-23(33-2)25(22)34-3)24(29)26(30)28-15-9-7-14-21(28)27(31)35-16-10-8-13-19-11-5-4-6-12-19/h4-6,11-12,17-18,21H,7-10,13-16H2,1-3H3