1-[2-(4,7-dimethyl-5-oxidanyl-2-oxidanylidene-chromen-3-yl)ethanoyl]-4-phenyl-piperidine-4-carboxylic acid

Systemtic Name: 1-[2-(4,7-dimethyl-5-oxidanyl-2-oxidanylidene-chromen-3-yl)ethanoyl]-4-phenyl-piperidine-4-carboxylic acid Openeye Name: 1-[2-(5-hydroxy-4,7-dimethyl-2-oxo-chromen-3-yl)acetyl]-4-phenyl-piperidine-4-carboxylic acid CAS Name: 1-[2-(5-hydroxy-4,7-dimethyl-2-oxo-1-benzopyran-3-yl)-1-oxoethyl]-4-phenyl-4-piperidinecarboxylic acid IUPAC Name: 1-[2-(5-hydroxy-4,7-dimethyl-2-oxochromen-3-yl)acetyl]-4-phenylpiperidine-4-carboxylic acid Traditional Name: 1-[2-(5-hydroxy-2-keto-4,7-dimethyl-chromen-3-yl)acetyl]-4-phenyl-isonipecotic acid Formula: C25H25NO6 MolecularWeight: 435.4691

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C(=C(C(=O)O2)CC(=O)N3CCC(CC3)(C4=CC=CC=C4)C(=O)O)C)C(=C1)O

Isomeric SMILES

CC1=CC2=C(C(=C(C(=O)O2)CC(=O)N3CCC(CC3)(C4=CC=CC=C4)C(=O)O)C)C(=C1)O

InChI

InChI=1S/C25H25NO6/c1-15-12-19(27)22-16(2)18(23(29)32-20(22)13-15)14-21(28)26-10-8-25(9-11-26,24(30)31)17-6-4-3-5-7-17/h3-7,12-13,27H,8-11,14H2,1-2H3,(H,30,31)