1-[3-(7-methoxy-4,8-dimethyl-2-oxidanylidene-chromen-3-yl)propanoyl]-4-phenyl-piperidine-4-carboxylic acid

Systemtic Name: 1-[3-(7-methoxy-4,8-dimethyl-2-oxidanylidene-chromen-3-yl)propanoyl]-4-phenyl-piperidine-4-carboxylic acid Openeye Name: 1-[3-(7-methoxy-4,8-dimethyl-2-oxo-chromen-3-yl)propanoyl]-4-phenyl-piperidine-4-carboxylic acid CAS Name: 1-[3-(7-methoxy-4,8-dimethyl-2-oxo-1-benzopyran-3-yl)-1-oxopropyl]-4-phenyl-4-piperidinecarboxylic acid IUPAC Name: 1-[3-(7-methoxy-4,8-dimethyl-2-oxochromen-3-yl)propanoyl]-4-phenylpiperidine-4-carboxylic acid Traditional Name: 1-[3-(2-keto-7-methoxy-4,8-dimethyl-chromen-3-yl)propanoyl]-4-phenyl-isonipecotic acid Formula: C27H29NO6 MolecularWeight: 463.52226

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=C1C=CC(=C2C)OC)CCC(=O)N3CCC(CC3)(C4=CC=CC=C4)C(=O)O

Isomeric SMILES

CC1=C(C(=O)OC2=C1C=CC(=C2C)OC)CCC(=O)N3CCC(CC3)(C4=CC=CC=C4)C(=O)O

InChI

InChI=1S/C27H29NO6/c1-17-20-9-11-22(33-3)18(2)24(20)34-25(30)21(17)10-12-23(29)28-15-13-27(14-16-28,26(31)32)19-7-5-4-6-8-19/h4-9,11H,10,12-16H2,1-3H3,(H,31,32)