2-[(4-methyl-2-nitro-phenyl)carbamoyl]-3-nitro-benzoic acid

Systemtic Name: 2-[(4-methyl-2-nitro-phenyl)carbamoyl]-3-nitro-benzoic acid Openeye Name: 2-[(4-methyl-2-nitro-phenyl)carbamoyl]-3-nitro-benzoic acid CAS Name: 2-[(4-methyl-2-nitroanilino)-oxomethyl]-3-nitrobenzoic acid IUPAC Name: 2-[(4-methyl-2-nitrophenyl)carbamoyl]-3-nitrobenzoic acid Traditional Name: 2-[(4-methyl-2-nitro-phenyl)carbamoyl]-3-nitro-benzoic acid Formula: C15H11N3O7 MolecularWeight: 345.26374

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)C2=C(C=CC=C2[N+](=O)[O-])C(=O)O)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)C2=C(C=CC=C2[N+](=O)[O-])C(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C15H11N3O7/c1-8-5-6-10(12(7-8)18(24)25)16-14(19)13-9(15(20)21)3-2-4-11(13)17(22)23/h2-7H,1H3,(H,16,19)(H,20,21)