2-(3-ethoxycarbonylphenyl)-2-(3-sulfophenyl)ethanoic acid

Systemtic Name: 2-(3-ethoxycarbonylphenyl)-2-(3-sulfophenyl)ethanoic acid Openeye Name: 2-(3-ethoxycarbonylphenyl)-2-(3-sulfophenyl)acetic acid CAS Name: 2-(3-ethoxycarbonylphenyl)-2-(3-sulfophenyl)acetic acid IUPAC Name: 2-(3-ethoxycarbonylphenyl)-2-(3-sulfophenyl)acetic acid Traditional Name: 2-(3-carbethoxyphenyl)-2-(3-sulfophenyl)acetic acid Formula: C17H16O7S MolecularWeight: 364.36974

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC=C1)C(C2=CC(=CC=C2)S(=O)(=O)O)C(=O)O

Isomeric SMILES

CCOC(=O)C1=CC(=CC=C1)C(C2=CC(=CC=C2)S(=O)(=O)O)C(=O)O

InChI

InChI=1S/C17H16O7S/c1-2-24-17(20)13-7-3-5-11(9-13)15(16(18)19)12-6-4-8-14(10-12)25(21,22)23/h3-10,15H,2H2,1H3,(H,18,19)(H,21,22,23)