methyl 3-[(2-methyl-4-nitro-phenyl)carbamoyl]-5-nitro-benzoate

Systemtic Name: methyl 3-[(2-methyl-4-nitro-phenyl)carbamoyl]-5-nitro-benzoate Openeye Name: methyl 3-[(2-methyl-4-nitro-phenyl)carbamoyl]-5-nitro-benzoate CAS Name: 3-[(2-methyl-4-nitroanilino)-oxomethyl]-5-nitrobenzoic acid methyl ester IUPAC Name: methyl 3-[(2-methyl-4-nitrophenyl)carbamoyl]-5-nitrobenzoate Traditional Name: 3-[(2-methyl-4-nitro-phenyl)carbamoyl]-5-nitro-benzoic acid methyl ester Formula: C16H13N3O7 MolecularWeight: 359.29032

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H13N3O7/c1-9-5-12(18(22)23)3-4-14(9)17-15(20)10-6-11(16(21)26-2)8-13(7-10)19(24)25/h3-8H,1-2H3,(H,17,20)