(Z)-3-[4-butyl-3-[4-methoxy-2-[(2-methoxycarbonylphenyl)methoxy]phenyl]thiophen-2-yl]-2-[(6-methoxy-1,3-benzodioxol-5-yl)methyl]prop-2-enoic acid

Systemtic Name: (Z)-3-[4-butyl-3-[4-methoxy-2-[(2-methoxycarbonylphenyl)methoxy]phenyl]thiophen-2-yl]-2-[(6-methoxy-1,3-benzodioxol-5-yl)methyl]prop-2-enoic acid Openeye Name: (Z)-3-[4-butyl-3-[4-methoxy-2-[(2-methoxycarbonylphenyl)methoxy]phenyl]-2-thienyl]-2-[(6-methoxy-1,3-benzodioxol-5-yl)methyl]prop-2-enoic acid CAS Name: (Z)-3-[4-butyl-3-[4-methoxy-2-[(2-methoxycarbonylphenyl)methoxy]phenyl]-2-thiophenyl]-2-[(6-methoxy-1,3-benzodioxol-5-yl)methyl]-2-propenoic acid IUPAC Name: (Z)-3-[4-butyl-3-[4-methoxy-2-[(2-methoxycarbonylphenyl)methoxy]phenyl]thiophen-2-yl]-2-[(6-methoxy-1,3-benzodioxol-5-yl)methyl]prop-2-enoic acid Traditional Name: (Z)-3-[4-butyl-3-[2-(2-carbomethoxybenzyl)oxy-4-methoxy-phenyl]-2-thienyl]-2-[(6-methoxy-1,3-benzodioxol-5-yl)methyl]acrylic acid Formula: C36H36O9S MolecularWeight: 644.73064

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CSC(=C1C2=C(C=C(C=C2)OC)OCC3=CC=CC=C3C(=O)OC)C=C(CC4=CC5=C(C=C4OC)OCO5)C(=O)O

Isomeric SMILES

CCCCC1=CSC(=C1C2=C(C=C(C=C2)OC)OCC3=CC=CC=C3C(=O)OC)/C=C(/CC4=CC5=C(C=C4OC)OCO5)\C(=O)O

InChI

InChI=1S/C36H36O9S/c1-5-6-9-23-20-46-33(16-25(35(37)38)14-24-15-31-32(45-21-44-31)18-29(24)41-3)34(23)28-13-12-26(40-2)17-30(28)43-19-22-10-7-8-11-27(22)36(39)42-4/h7-8,10-13,15-18,20H,5-6,9,14,19,21H2,1-4H3,(H,37,38)/b25-16-