1-[2-[4,7-dimethyl-5-(2-methylprop-2-enoxy)-2-oxidanylidene-chromen-3-yl]ethanoyl]-4-phenyl-piperidine-4-carboxylic acid

Systemtic Name: 1-[2-[4,7-dimethyl-5-(2-methylprop-2-enoxy)-2-oxidanylidene-chromen-3-yl]ethanoyl]-4-phenyl-piperidine-4-carboxylic acid Openeye Name: 1-[2-[4,7-dimethyl-5-(2-methylallyloxy)-2-oxo-chromen-3-yl]acetyl]-4-phenyl-piperidine-4-carboxylic acid CAS Name: 1-[2-[4,7-dimethyl-5-(2-methylprop-2-enoxy)-2-oxo-1-benzopyran-3-yl]-1-oxoethyl]-4-phenyl-4-piperidinecarboxylic acid IUPAC Name: 1-[2-[4,7-dimethyl-5-(2-methylprop-2-enoxy)-2-oxochromen-3-yl]acetyl]-4-phenylpiperidine-4-carboxylic acid Traditional Name: 1-[2-[2-keto-4,7-dimethyl-5-(2-methylallyloxy)chromen-3-yl]acetyl]-4-phenyl-isonipecotic acid Formula: C29H31NO6 MolecularWeight: 489.55954

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C29H31NO6/c1-18(2)17-35-23-14-19(3)15-24-26(23)20(4)22(27(32)36-24)16-25(31)30-12-10-29(11-13-30,28(33)34)21-8-6-5-7-9-21/h5-9,14-15H,1,10-13,16-17H2,2-4H3,(H,33,34)