[3-(3,4-dimethoxyphenyl)-1-(3-hydroxyphenyl)propyl] 1-(3,3-dimethyl-2-oxidanylidene-pentanoyl)piperidine-2-carboxylate

Systemtic Name: [3-(3,4-dimethoxyphenyl)-1-(3-hydroxyphenyl)propyl] 1-(3,3-dimethyl-2-oxidanylidene-pentanoyl)piperidine-2-carboxylate Openeye Name: [3-(3,4-dimethoxyphenyl)-1-(3-hydroxyphenyl)propyl] 1-(3,3-dimethyl-2-oxo-pentanoyl)piperidine-2-carboxylate CAS Name: 1-(3,3-dimethyl-1,2-dioxopentyl)-2-piperidinecarboxylic acid [3-(3,4-dimethoxyphenyl)-1-(3-hydroxyphenyl)propyl] ester IUPAC Name: [3-(3,4-dimethoxyphenyl)-1-(3-hydroxyphenyl)propyl] 1-(3,3-dimethyl-2-oxopentanoyl)piperidine-2-carboxylate Traditional Name: 1-(2-keto-3,3-dimethyl-pentanoyl)pipecolinic acid [3-(3,4-dimethoxyphenyl)-1-(3-hydroxyphenyl)propyl] ester Formula: C30H39NO7 MolecularWeight: 525.63316

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C(=O)C(=O)N1CCCCC1C(=O)OC(CCC2=CC(=C(C=C2)OC)OC)C3=CC(=CC=C3)O

Isomeric SMILES

CCC(C)(C)C(=O)C(=O)N1CCCCC1C(=O)OC(CCC2=CC(=C(C=C2)OC)OC)C3=CC(=CC=C3)O

InChI

InChI=1S/C30H39NO7/c1-6-30(2,3)27(33)28(34)31-17-8-7-12-23(31)29(35)38-24(21-10-9-11-22(32)19-21)15-13-20-14-16-25(36-4)26(18-20)37-5/h9-11,14,16,18-19,23-24,32H,6-8,12-13,15,17H2,1-5H3