2-[1-ethoxycarbonyl-6-(4-methylphenyl)-2-oxidanylidene-4-phenylmethoxy-cyclohex-3-en-1-yl]ethanoic acid

Systemtic Name: 2-[1-ethoxycarbonyl-6-(4-methylphenyl)-2-oxidanylidene-4-phenylmethoxy-cyclohex-3-en-1-yl]ethanoic acid Openeye Name: 2-[4-benzyloxy-1-ethoxycarbonyl-2-oxo-6-(p-tolyl)cyclohex-3-en-1-yl]acetic acid CAS Name: 2-[1-ethoxycarbonyl-6-(4-methylphenyl)-2-oxo-4-phenylmethoxy-1-cyclohex-3-enyl]acetic acid IUPAC Name: 2-[1-ethoxycarbonyl-6-(4-methylphenyl)-2-oxo-4-phenylmethoxycyclohex-3-en-1-yl]acetic acid Traditional Name: 2-[4-benzoxy-1-carbethoxy-2-keto-6-(p-tolyl)cyclohex-3-en-1-yl]acetic acid Formula: C25H26O6 MolecularWeight: 422.47034

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(C(CC(=CC1=O)OCC2=CC=CC=C2)C3=CC=C(C=C3)C)CC(=O)O

Isomeric SMILES

CCOC(=O)C1(C(CC(=CC1=O)OCC2=CC=CC=C2)C3=CC=C(C=C3)C)CC(=O)O

InChI

InChI=1S/C25H26O6/c1-3-30-24(29)25(15-23(27)28)21(19-11-9-17(2)10-12-19)13-20(14-22(25)26)31-16-18-7-5-4-6-8-18/h4-12,14,21H,3,13,15-16H2,1-2H3,(H,27,28)