1-(1,3-benzodioxol-5-yl)-3-[2-(2-carboxyethyl)-4-methoxy-phenyl]-5-propoxy-2,3-dihydro-1H-indene-2-carboxylic acid

Systemtic Name: 1-(1,3-benzodioxol-5-yl)-3-[2-(2-carboxyethyl)-4-methoxy-phenyl]-5-propoxy-2,3-dihydro-1H-indene-2-carboxylic acid Openeye Name: 1-(1,3-benzodioxol-5-yl)-3-[2-(2-carboxyethyl)-4-methoxy-phenyl]-5-propoxy-indane-2-carboxylic acid CAS Name: 1-(1,3-benzodioxol-5-yl)-3-[2-(2-carboxyethyl)-4-methoxyphenyl]-5-propoxy-2,3-dihydro-1H-indene-2-carboxylic acid IUPAC Name: 1-(1,3-benzodioxol-5-yl)-3-[2-(2-carboxyethyl)-4-methoxyphenyl]-5-propoxy-2,3-dihydro-1H-indene-2-carboxylic acid Traditional Name: 1-(1,3-benzodioxol-5-yl)-3-[2-(2-carboxyethyl)-4-methoxy-phenyl]-5-propoxy-indane-2-carboxylic acid Formula: C30H30O8 MolecularWeight: 518.5544

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC2=C(C=C1)C(C(C2C3=C(C=C(C=C3)OC)CCC(=O)O)C(=O)O)C4=CC5=C(C=C4)OCO5

Isomeric SMILES

CCCOC1=CC2=C(C=C1)C(C(C2C3=C(C=C(C=C3)OC)CCC(=O)O)C(=O)O)C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C30H30O8/c1-3-12-36-20-7-9-22-23(15-20)28(21-8-6-19(35-2)13-17(21)5-11-26(31)32)29(30(33)34)27(22)18-4-10-24-25(14-18)38-16-37-24/h4,6-10,13-15,27-29H,3,5,11-12,16H2,1-2H3,(H,31,32)(H,33,34)