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

Systemtic Name: 1-[2-[4-methyl-2-oxidanylidene-3-(phenylmethyl)chromen-7-yl]oxyethanoyl]-4-phenyl-piperidine-4-carboxylic acid Openeye Name: 1-[2-(3-benzyl-4-methyl-2-oxo-chromen-7-yl)oxyacetyl]-4-phenyl-piperidine-4-carboxylic acid CAS Name: 1-[2-[[4-methyl-2-oxo-3-(phenylmethyl)-1-benzopyran-7-yl]oxy]-1-oxoethyl]-4-phenyl-4-piperidinecarboxylic acid IUPAC Name: 1-[2-(3-benzyl-4-methyl-2-oxochromen-7-yl)oxyacetyl]-4-phenylpiperidine-4-carboxylic acid Traditional Name: 1-[2-(3-benzyl-2-keto-4-methyl-chromen-7-yl)oxyacetyl]-4-phenyl-isonipecotic acid Formula: C31H29NO6 MolecularWeight: 511.56506

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=C1C=CC(=C2)OCC(=O)N3CCC(CC3)(C4=CC=CC=C4)C(=O)O)CC5=CC=CC=C5

Isomeric SMILES

CC1=C(C(=O)OC2=C1C=CC(=C2)OCC(=O)N3CCC(CC3)(C4=CC=CC=C4)C(=O)O)CC5=CC=CC=C5

InChI

InChI=1S/C31H29NO6/c1-21-25-13-12-24(19-27(25)38-29(34)26(21)18-22-8-4-2-5-9-22)37-20-28(33)32-16-14-31(15-17-32,30(35)36)23-10-6-3-7-11-23/h2-13,19H,14-18,20H2,1H3,(H,35,36)