4-(4-methoxyphenyl)butyl (2S)-1-(3,3-dimethyl-2-oxidanylidene-butanoyl)piperidine-2-carboxylate

Systemtic Name: 4-(4-methoxyphenyl)butyl (2S)-1-(3,3-dimethyl-2-oxidanylidene-butanoyl)piperidine-2-carboxylate Openeye Name: 4-(4-methoxyphenyl)butyl (2S)-1-(3,3-dimethyl-2-oxo-butanoyl)piperidine-2-carboxylate CAS Name: (2S)-1-(3,3-dimethyl-1,2-dioxobutyl)-2-piperidinecarboxylic acid 4-(4-methoxyphenyl)butyl ester IUPAC Name: 4-(4-methoxyphenyl)butyl (2S)-1-(3,3-dimethyl-2-oxobutanoyl)piperidine-2-carboxylate Traditional Name: (2S)-1-(2-keto-3,3-dimethyl-butanoyl)pipecolinic acid 4-(4-methoxyphenyl)butyl ester Formula: C23H33NO5 MolecularWeight: 403.51182

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)C(=O)N1CCCCC1C(=O)OCCCCC2=CC=C(C=C2)OC

Isomeric SMILES

CC(C)(C)C(=O)C(=O)N1CCCC[C@H]1C(=O)OCCCCC2=CC=C(C=C2)OC

InChI

InChI=1S/C23H33NO5/c1-23(2,3)20(25)21(26)24-15-7-5-10-19(24)22(27)29-16-8-6-9-17-11-13-18(28-4)14-12-17/h11-14,19H,5-10,15-16H2,1-4H3/t19-/m0/s1