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

Systemtic Name: 1-[2-(4,8-dimethyl-7-oxidanyl-2-oxidanylidene-chromen-3-yl)ethanoyl]-4-phenyl-piperidine-4-carboxylic acid Openeye Name: 1-[2-(7-hydroxy-4,8-dimethyl-2-oxo-chromen-3-yl)acetyl]-4-phenyl-piperidine-4-carboxylic acid CAS Name: 1-[2-(7-hydroxy-4,8-dimethyl-2-oxo-1-benzopyran-3-yl)-1-oxoethyl]-4-phenyl-4-piperidinecarboxylic acid IUPAC Name: 1-[2-(7-hydroxy-4,8-dimethyl-2-oxochromen-3-yl)acetyl]-4-phenylpiperidine-4-carboxylic acid Traditional Name: 1-[2-(7-hydroxy-2-keto-4,8-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=C(C(=O)OC2=C1C=CC(=C2C)O)CC(=O)N3CCC(CC3)(C4=CC=CC=C4)C(=O)O

Isomeric SMILES

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

InChI

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