2-[(2-carboxylatophenyl)-(3,5-dinitrophenyl)carbonyl-carbamoyl]benzoate

Systemtic Name: 2-[(2-carboxylatophenyl)-(3,5-dinitrophenyl)carbonyl-carbamoyl]benzoate Openeye Name: 2-[(2-carboxylatophenyl)-(3,5-dinitrobenzoyl)carbamoyl]benzoate CAS Name: 2-[(2-carboxylato-N-[(3,5-dinitrophenyl)-oxomethyl]anilino)-oxomethyl]benzoate IUPAC Name: 2-[(2-carboxylatophenyl)-(3,5-dinitrobenzoyl)carbamoyl]benzoate Traditional Name: 2-[(2-carboxylatophenyl)-(3,5-dinitrobenzoyl)carbamoyl]benzoate Formula: C22H11N3O10-2 MolecularWeight: 477.33684

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)N(C2=CC=CC=C2C(=O)[O-])C(=O)C3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-])C(=O)[O-]

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)N(C2=CC=CC=C2C(=O)[O-])C(=O)C3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-])C(=O)[O-]

InChI

InChI=1S/C22H13N3O10/c26-19(12-9-13(24(32)33)11-14(10-12)25(34)35)23(18-8-4-3-7-17(18)22(30)31)20(27)15-5-1-2-6-16(15)21(28)29/h1-11H,(H,28,29)(H,30,31)/p-2