1-[3-[4-methyl-7-(2-methylprop-2-enoxy)-2-oxidanylidene-chromen-3-yl]propanoyl]-4-phenyl-piperidine-4-carboxylic acid

Systemtic Name: 1-[3-[4-methyl-7-(2-methylprop-2-enoxy)-2-oxidanylidene-chromen-3-yl]propanoyl]-4-phenyl-piperidine-4-carboxylic acid Openeye Name: 1-[3-[4-methyl-7-(2-methylallyloxy)-2-oxo-chromen-3-yl]propanoyl]-4-phenyl-piperidine-4-carboxylic acid CAS Name: 1-[3-[4-methyl-7-(2-methylprop-2-enoxy)-2-oxo-1-benzopyran-3-yl]-1-oxopropyl]-4-phenyl-4-piperidinecarboxylic acid IUPAC Name: 1-[3-[4-methyl-7-(2-methylprop-2-enoxy)-2-oxochromen-3-yl]propanoyl]-4-phenylpiperidine-4-carboxylic acid Traditional Name: 1-[3-[2-keto-4-methyl-7-(2-methylallyloxy)chromen-3-yl]propanoyl]-4-phenyl-isonipecotic acid Formula: C29H31NO6 MolecularWeight: 489.55954

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C29H31NO6/c1-19(2)18-35-22-9-10-23-20(3)24(27(32)36-25(23)17-22)11-12-26(31)30-15-13-29(14-16-30,28(33)34)21-7-5-4-6-8-21/h4-10,17H,1,11-16,18H2,2-3H3,(H,33,34)