1-[3-(4,11-dimethyl-2-oxidanylidene-6,7,8,9-tetrahydro-[1]benzofuro[3,2-g]chromen-3-yl)propanoyl]-4-phenyl-piperidine-4-carboxylic acid

Systemtic Name: 1-[3-(4,11-dimethyl-2-oxidanylidene-6,7,8,9-tetrahydro-[1]benzofuro[3,2-g]chromen-3-yl)propanoyl]-4-phenyl-piperidine-4-carboxylic acid Openeye Name: 1-[3-(4,11-dimethyl-2-oxo-6,7,8,9-tetrahydrobenzofuro[3,2-g]chromen-3-yl)propanoyl]-4-phenyl-piperidine-4-carboxylic acid CAS Name: 1-[3-(4,11-dimethyl-2-oxo-6,7,8,9-tetrahydrobenzofuro[3,2-g][1]benzopyran-3-yl)-1-oxopropyl]-4-phenyl-4-piperidinecarboxylic acid IUPAC Name: 1-[3-(4,11-dimethyl-2-oxo-6,7,8,9-tetrahydro-[1]benzofuro[3,2-g]chromen-3-yl)propanoyl]-4-phenylpiperidine-4-carboxylic acid Traditional Name: 1-[3-(2-keto-4,11-dimethyl-6,7,8,9-tetrahydrobenzofuro[3,2-g]chromen-3-yl)propanoyl]-4-phenyl-isonipecotic acid Formula: C32H33NO6 MolecularWeight: 527.60752

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=C1C=C3C4=C(CCCC4)OC3=C2C)CCC(=O)N5CCC(CC5)(C6=CC=CC=C6)C(=O)O

Isomeric SMILES

CC1=C(C(=O)OC2=C1C=C3C4=C(CCCC4)OC3=C2C)CCC(=O)N5CCC(CC5)(C6=CC=CC=C6)C(=O)O

InChI

InChI=1S/C32H33NO6/c1-19-22(12-13-27(34)33-16-14-32(15-17-33,31(36)37)21-8-4-3-5-9-21)30(35)39-28-20(2)29-25(18-24(19)28)23-10-6-7-11-26(23)38-29/h3-5,8-9,18H,6-7,10-17H2,1-2H3,(H,36,37)