(E,2Z)-4-(4-cyclopentyloxy-3-methoxy-phenyl)-3-methoxycarbonyl-2-(phenylmethylidene)but-3-enoic acid

Systemtic Name: (E,2Z)-4-(4-cyclopentyloxy-3-methoxy-phenyl)-3-methoxycarbonyl-2-(phenylmethylidene)but-3-enoic acid Openeye Name: (E,2Z)-2-benzylidene-4-[4-(cyclopentoxy)-3-methoxy-phenyl]-3-methoxycarbonyl-but-3-enoic acid CAS Name: (E,2Z)-4-(4-cyclopentyloxy-3-methoxyphenyl)-3-methoxycarbonyl-2-(phenylmethylene)-3-butenoic acid IUPAC Name: (E,2Z)-2-benzylidene-4-(4-cyclopentyloxy-3-methoxyphenyl)-3-methoxycarbonylbut-3-enoic acid Traditional Name: (E,2Z)-2-benzal-3-carbomethoxy-4-[4-(cyclopentoxy)-3-methoxy-phenyl]but-3-enoic acid Formula: C25H26O6 MolecularWeight: 422.47034

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=C(C(=CC2=CC=CC=C2)C(=O)O)C(=O)OC)OC3CCCC3

Isomeric SMILES

COC1=C(C=CC(=C1)/C=C(\C(=C\C2=CC=CC=C2)\C(=O)O)/C(=O)OC)OC3CCCC3

InChI

InChI=1S/C25H26O6/c1-29-23-16-18(12-13-22(23)31-19-10-6-7-11-19)15-21(25(28)30-2)20(24(26)27)14-17-8-4-3-5-9-17/h3-5,8-9,12-16,19H,6-7,10-11H2,1-2H3,(H,26,27)/b20-14-,21-15+