4-phenyl-1-[2-(3,4,7-trimethyl-2-oxidanylidene-chromen-5-yl)oxyethanoyl]piperidine-4-carboxylic acid

Systemtic Name: 4-phenyl-1-[2-(3,4,7-trimethyl-2-oxidanylidene-chromen-5-yl)oxyethanoyl]piperidine-4-carboxylic acid Openeye Name: 4-phenyl-1-[2-(3,4,7-trimethyl-2-oxo-chromen-5-yl)oxyacetyl]piperidine-4-carboxylic acid CAS Name: 1-[1-oxo-2-[(3,4,7-trimethyl-2-oxo-1-benzopyran-5-yl)oxy]ethyl]-4-phenyl-4-piperidinecarboxylic acid IUPAC Name: 4-phenyl-1-[2-(3,4,7-trimethyl-2-oxochromen-5-yl)oxyacetyl]piperidine-4-carboxylic acid Traditional Name: 1-[2-(2-keto-3,4,7-trimethyl-chromen-5-yl)oxyacetyl]-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)C)C)C(=C1)OCC(=O)N3CCC(CC3)(C4=CC=CC=C4)C(=O)O

Isomeric SMILES

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

InChI

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