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

Systemtic Name: 1-[2-(5-methoxy-4,7-dimethyl-2-oxidanylidene-chromen-3-yl)ethanoyl]-4-phenyl-piperidine-4-carboxylic acid Openeye Name: 1-[2-(5-methoxy-4,7-dimethyl-2-oxo-chromen-3-yl)acetyl]-4-phenyl-piperidine-4-carboxylic acid CAS Name: 1-[2-(5-methoxy-4,7-dimethyl-2-oxo-1-benzopyran-3-yl)-1-oxoethyl]-4-phenyl-4-piperidinecarboxylic acid IUPAC Name: 1-[2-(5-methoxy-4,7-dimethyl-2-oxochromen-3-yl)acetyl]-4-phenylpiperidine-4-carboxylic acid Traditional Name: 1-[2-(2-keto-5-methoxy-4,7-dimethyl-chromen-3-yl)acetyl]-4-phenyl-isonipecotic acid Formula: C26H27NO6 MolecularWeight: 449.49568

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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)OC

Isomeric SMILES

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

InChI

InChI=1S/C26H27NO6/c1-16-13-20(32-3)23-17(2)19(24(29)33-21(23)14-16)15-22(28)27-11-9-26(10-12-27,25(30)31)18-7-5-4-6-8-18/h4-8,13-14H,9-12,15H2,1-3H3,(H,30,31)