3-chloranyl-4-methoxy-5-[(3-methyl-4-nitro-phenyl)carbonylamino]benzoate

Systemtic Name: 3-chloranyl-4-methoxy-5-[(3-methyl-4-nitro-phenyl)carbonylamino]benzoate Openeye Name: 3-chloro-4-methoxy-5-[(3-methyl-4-nitro-benzoyl)amino]benzoate CAS Name: 3-chloro-4-methoxy-5-[[(3-methyl-4-nitrophenyl)-oxomethyl]amino]benzoate IUPAC Name: 3-chloro-4-methoxy-5-[(3-methyl-4-nitrobenzoyl)amino]benzoate Traditional Name: 3-chloro-4-methoxy-5-[(3-methyl-4-nitro-benzoyl)amino]benzoate Formula: C16H12ClN2O6- MolecularWeight: 363.72928

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)NC2=C(C(=CC(=C2)C(=O)[O-])Cl)OC)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)NC2=C(C(=CC(=C2)C(=O)[O-])Cl)OC)[N+](=O)[O-]

InChI

InChI=1S/C16H13ClN2O6/c1-8-5-9(3-4-13(8)19(23)24)15(20)18-12-7-10(16(21)22)6-11(17)14(12)25-2/h3-7H,1-2H3,(H,18,20)(H,21,22)/p-1