3-phenylpropyl 3-(3,3-dimethyl-2-oxidanylidene-butanoyl)-1,3-dimethyl-piperidine-2-carboxylate

Systemtic Name: 3-phenylpropyl 3-(3,3-dimethyl-2-oxidanylidene-butanoyl)-1,3-dimethyl-piperidine-2-carboxylate Openeye Name: 3-phenylpropyl 3-(3,3-dimethyl-2-oxo-butanoyl)-1,3-dimethyl-piperidine-2-carboxylate CAS Name: 3-(3,3-dimethyl-1,2-dioxobutyl)-1,3-dimethyl-2-piperidinecarboxylic acid 3-phenylpropyl ester IUPAC Name: 3-phenylpropyl 3-(3,3-dimethyl-2-oxobutanoyl)-1,3-dimethylpiperidine-2-carboxylate Traditional Name: 3-(2-keto-3,3-dimethyl-butanoyl)-1,3-dimethyl-pipecolinic acid 3-phenylpropyl ester Formula: C23H33NO4 MolecularWeight: 387.51242

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCCN(C1C(=O)OCCCC2=CC=CC=C2)C)C(=O)C(=O)C(C)(C)C

Isomeric SMILES

CC1(CCCN(C1C(=O)OCCCC2=CC=CC=C2)C)C(=O)C(=O)C(C)(C)C

InChI

InChI=1S/C23H33NO4/c1-22(2,3)19(25)20(26)23(4)14-10-15-24(5)18(23)21(27)28-16-9-13-17-11-7-6-8-12-17/h6-8,11-12,18H,9-10,13-16H2,1-5H3