2-[[4-[(2-bromophenyl)carbonylamino]-2,5-diethoxy-phenyl]carbamoyl]benzoic acid

Systemtic Name: 2-[[4-[(2-bromophenyl)carbonylamino]-2,5-diethoxy-phenyl]carbamoyl]benzoic acid Openeye Name: 2-[[4-[(2-bromobenzoyl)amino]-2,5-diethoxy-phenyl]carbamoyl]benzoic acid CAS Name: 2-[[4-[[(2-bromophenyl)-oxomethyl]amino]-2,5-diethoxyanilino]-oxomethyl]benzoic acid IUPAC Name: 2-[[4-[(2-bromobenzoyl)amino]-2,5-diethoxyphenyl]carbamoyl]benzoic acid Traditional Name: 2-[[4-[(2-bromobenzoyl)amino]-2,5-diethoxy-phenyl]carbamoyl]benzoic acid Formula: C25H23BrN2O6 MolecularWeight: 527.36392

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=C(C=C1NC(=O)C2=CC=CC=C2C(=O)O)OCC)NC(=O)C3=CC=CC=C3Br

Isomeric SMILES

CCOC1=CC(=C(C=C1NC(=O)C2=CC=CC=C2C(=O)O)OCC)NC(=O)C3=CC=CC=C3Br

InChI

InChI=1S/C25H23BrN2O6/c1-3-33-21-14-20(28-24(30)17-11-7-8-12-18(17)26)22(34-4-2)13-19(21)27-23(29)15-9-5-6-10-16(15)25(31)32/h5-14H,3-4H2,1-2H3,(H,27,29)(H,28,30)(H,31,32)