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

Systemtic Name: 1-(1,3-benzodioxol-5-yl)-3-(4-ethoxyphenyl)-2,3-dihydro-1H-indene-2-carboxylic acid Openeye Name: 1-(1,3-benzodioxol-5-yl)-3-(4-ethoxyphenyl)indane-2-carboxylic acid CAS Name: 1-(1,3-benzodioxol-5-yl)-3-(4-ethoxyphenyl)-2,3-dihydro-1H-indene-2-carboxylic acid IUPAC Name: 1-(1,3-benzodioxol-5-yl)-3-(4-ethoxyphenyl)-2,3-dihydro-1H-indene-2-carboxylic acid Traditional Name: 1-(1,3-benzodioxol-5-yl)-3-p-phenetyl-indane-2-carboxylic acid Formula: C25H22O5 MolecularWeight: 402.43918

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2C(C(C3=CC=CC=C23)C4=CC5=C(C=C4)OCO5)C(=O)O

Isomeric SMILES

CCOC1=CC=C(C=C1)C2C(C(C3=CC=CC=C23)C4=CC5=C(C=C4)OCO5)C(=O)O

InChI

InChI=1S/C25H22O5/c1-2-28-17-10-7-15(8-11-17)22-18-5-3-4-6-19(18)23(24(22)25(26)27)16-9-12-20-21(13-16)30-14-29-20/h3-13,22-24H,2,14H2,1H3,(H,26,27)