1-(1,3-benzodioxol-5-yl)-3-(4-methoxyphenyl)-5-prop-2-enoxy-2,3-dihydro-1H-indene-2-carboxylic acid

Systemtic Name: 1-(1,3-benzodioxol-5-yl)-3-(4-methoxyphenyl)-5-prop-2-enoxy-2,3-dihydro-1H-indene-2-carboxylic acid Openeye Name: 5-allyloxy-1-(1,3-benzodioxol-5-yl)-3-(4-methoxyphenyl)indane-2-carboxylic acid CAS Name: 1-(1,3-benzodioxol-5-yl)-3-(4-methoxyphenyl)-5-prop-2-enoxy-2,3-dihydro-1H-indene-2-carboxylic acid IUPAC Name: 1-(1,3-benzodioxol-5-yl)-3-(4-methoxyphenyl)-5-prop-2-enoxy-2,3-dihydro-1H-indene-2-carboxylic acid Traditional Name: 5-allyloxy-1-(1,3-benzodioxol-5-yl)-3-(4-methoxyphenyl)indane-2-carboxylic acid Formula: C27H24O6 MolecularWeight: 444.47586

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2C(C(C3=C2C=C(C=C3)OCC=C)C4=CC5=C(C=C4)OCO5)C(=O)O

Isomeric SMILES

COC1=CC=C(C=C1)C2C(C(C3=C2C=C(C=C3)OCC=C)C4=CC5=C(C=C4)OCO5)C(=O)O

InChI

InChI=1S/C27H24O6/c1-3-12-31-19-9-10-20-21(14-19)24(16-4-7-18(30-2)8-5-16)26(27(28)29)25(20)17-6-11-22-23(13-17)33-15-32-22/h3-11,13-14,24-26H,1,12,15H2,2H3,(H,28,29)