3-diphenylphosphanyl-4-methoxycarbonyl-benzoic acid

Systemtic Name: 3-diphenylphosphanyl-4-methoxycarbonyl-benzoic acid Openeye Name: 3-diphenylphosphanyl-4-methoxycarbonyl-benzoic acid CAS Name: 3-diphenylphosphino-4-methoxycarbonylbenzoic acid IUPAC Name: 3-diphenylphosphanyl-4-methoxycarbonylbenzoic acid Traditional Name: 4-carbomethoxy-3-diphenylphosphino-benzoic acid Formula: C21H17O4P MolecularWeight: 364.331041

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=C(C=C1)C(=O)O)P(C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

COC(=O)C1=C(C=C(C=C1)C(=O)O)P(C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C21H17O4P/c1-25-21(24)18-13-12-15(20(22)23)14-19(18)26(16-8-4-2-5-9-16)17-10-6-3-7-11-17/h2-14H,1H3,(H,22,23)