2-[(4-methoxyphenyl)carbamoyl]-3,6-dinitro-benzoic acid

Systemtic Name: 2-[(4-methoxyphenyl)carbamoyl]-3,6-dinitro-benzoic acid Openeye Name: 2-[(4-methoxyphenyl)carbamoyl]-3,6-dinitro-benzoic acid CAS Name: 2-[(4-methoxyanilino)-oxomethyl]-3,6-dinitrobenzoic acid IUPAC Name: 2-[(4-methoxyphenyl)carbamoyl]-3,6-dinitrobenzoic acid Traditional Name: 2-[(4-methoxyphenyl)carbamoyl]-3,6-dinitro-benzoic acid Formula: C15H11N3O8 MolecularWeight: 361.26314

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=O)C2=C(C=CC(=C2C(=O)O)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)NC(=O)C2=C(C=CC(=C2C(=O)O)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C15H11N3O8/c1-26-9-4-2-8(3-5-9)16-14(19)12-10(17(22)23)6-7-11(18(24)25)13(12)15(20)21/h2-7H,1H3,(H,16,19)(H,20,21)