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

Systemtic Name: 1-[2-(4-methyl-7-oxidanyl-2-oxidanylidene-chromen-3-yl)ethanoyl]-4-phenyl-piperidine-4-carboxylic acid Openeye Name: 1-[2-(7-hydroxy-4-methyl-2-oxo-chromen-3-yl)acetyl]-4-phenyl-piperidine-4-carboxylic acid CAS Name: 1-[2-(7-hydroxy-4-methyl-2-oxo-1-benzopyran-3-yl)-1-oxoethyl]-4-phenyl-4-piperidinecarboxylic acid IUPAC Name: 1-[2-(7-hydroxy-4-methyl-2-oxochromen-3-yl)acetyl]-4-phenylpiperidine-4-carboxylic acid Traditional Name: 1-[2-(7-hydroxy-2-keto-4-methyl-chromen-3-yl)acetyl]-4-phenyl-isonipecotic acid Formula: C24H23NO6 MolecularWeight: 421.44252

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=C1C=CC(=C2)O)CC(=O)N3CCC(CC3)(C4=CC=CC=C4)C(=O)O

Isomeric SMILES

CC1=C(C(=O)OC2=C1C=CC(=C2)O)CC(=O)N3CCC(CC3)(C4=CC=CC=C4)C(=O)O

InChI

InChI=1S/C24H23NO6/c1-15-18-8-7-17(26)13-20(18)31-22(28)19(15)14-21(27)25-11-9-24(10-12-25,23(29)30)16-5-3-2-4-6-16/h2-8,13,26H,9-12,14H2,1H3,(H,29,30)