5-[3-carboxy-4-[(3-carboxyphenyl)carbamoyl]phenyl]-2-[(4-carboxyphenyl)carbamoyl]benzoic acid

Systemtic Name: 5-[3-carboxy-4-[(3-carboxyphenyl)carbamoyl]phenyl]-2-[(4-carboxyphenyl)carbamoyl]benzoic acid Openeye Name: 5-[3-carboxy-4-[(3-carboxyphenyl)carbamoyl]phenyl]-2-[(4-carboxyphenyl)carbamoyl]benzoic acid CAS Name: 2-[(4-carboxyanilino)-oxomethyl]-5-[3-carboxy-4-[(3-carboxyanilino)-oxomethyl]phenyl]benzoic acid IUPAC Name: 5-[3-carboxy-4-[(3-carboxyphenyl)carbamoyl]phenyl]-2-[(4-carboxyphenyl)carbamoyl]benzoic acid Traditional Name: 5-[3-carboxy-4-[(3-carboxyphenyl)carbamoyl]phenyl]-2-[(4-carboxyphenyl)carbamoyl]benzoic acid Formula: C30H20N2O10 MolecularWeight: 568.4872

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NC(=O)C2=C(C=C(C=C2)C3=CC(=C(C=C3)C(=O)NC4=CC=C(C=C4)C(=O)O)C(=O)O)C(=O)O)C(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)NC(=O)C2=C(C=C(C=C2)C3=CC(=C(C=C3)C(=O)NC4=CC=C(C=C4)C(=O)O)C(=O)O)C(=O)O)C(=O)O

InChI

InChI=1S/C30H20N2O10/c33-25(31-19-8-4-15(5-9-19)27(35)36)21-10-6-16(13-23(21)29(39)40)17-7-11-22(24(14-17)30(41)42)26(34)32-20-3-1-2-18(12-20)28(37)38/h1-14H,(H,31,33)(H,32,34)(H,35,36)(H,37,38)(H,39,40)(H,41,42)