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

Systemtic Name: 4-(4-methoxyphenyl)butyl 3-(3,3-dimethyl-2-oxidanylidene-pentanoyl)-1,3-dimethyl-piperidine-2-carboxylate Openeye Name: 4-(4-methoxyphenyl)butyl 3-(3,3-dimethyl-2-oxo-pentanoyl)-1,3-dimethyl-piperidine-2-carboxylate CAS Name: 3-(3,3-dimethyl-1,2-dioxopentyl)-1,3-dimethyl-2-piperidinecarboxylic acid 4-(4-methoxyphenyl)butyl ester IUPAC Name: 4-(4-methoxyphenyl)butyl 3-(3,3-dimethyl-2-oxopentanoyl)-1,3-dimethylpiperidine-2-carboxylate Traditional Name: 3-(2-keto-3,3-dimethyl-pentanoyl)-1,3-dimethyl-pipecolinic acid 4-(4-methoxyphenyl)butyl ester Formula: C26H39NO5 MolecularWeight: 445.59156

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C(=O)C(=O)C1(CCCN(C1C(=O)OCCCCC2=CC=C(C=C2)OC)C)C

Isomeric SMILES

CCC(C)(C)C(=O)C(=O)C1(CCCN(C1C(=O)OCCCCC2=CC=C(C=C2)OC)C)C

InChI

InChI=1S/C26H39NO5/c1-7-25(2,3)22(28)23(29)26(4)16-10-17-27(5)21(26)24(30)32-18-9-8-11-19-12-14-20(31-6)15-13-19/h12-15,21H,7-11,16-18H2,1-6H3