methyl 3-[(6-methyl-2-oxidanylidene-1,3-dihydrobenzimidazol-5-yl)carbamoyl]-5-nitro-benzoate

Systemtic Name: methyl 3-[(6-methyl-2-oxidanylidene-1,3-dihydrobenzimidazol-5-yl)carbamoyl]-5-nitro-benzoate Openeye Name: methyl 3-[(6-methyl-2-oxo-1,3-dihydrobenzimidazol-5-yl)carbamoyl]-5-nitro-benzoate CAS Name: 3-[[(6-methyl-2-oxo-1,3-dihydrobenzimidazol-5-yl)amino]-oxomethyl]-5-nitrobenzoic acid methyl ester IUPAC Name: methyl 3-[(6-methyl-2-oxo-1,3-dihydrobenzimidazol-5-yl)carbamoyl]-5-nitrobenzoate Traditional Name: 3-[(2-keto-6-methyl-1,3-dihydrobenzimidazol-5-yl)carbamoyl]-5-nitro-benzoic acid methyl ester Formula: C17H14N4O6 MolecularWeight: 370.31626

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1NC(=O)C3=CC(=CC(=C3)[N+](=O)[O-])C(=O)OC)NC(=O)N2

Isomeric SMILES

CC1=CC2=C(C=C1NC(=O)C3=CC(=CC(=C3)[N+](=O)[O-])C(=O)OC)NC(=O)N2

InChI

InChI=1S/C17H14N4O6/c1-8-3-13-14(20-17(24)19-13)7-12(8)18-15(22)9-4-10(16(23)27-2)6-11(5-9)21(25)26/h3-7H,1-2H3,(H,18,22)(H2,19,20,24)