methyl 4-[[methyl-(3-methyl-5-nitro-imidazol-4-yl)amino]methyl]benzoate

Systemtic Name: methyl 4-[[methyl-(3-methyl-5-nitro-imidazol-4-yl)amino]methyl]benzoate Openeye Name: methyl 4-[[methyl-(3-methyl-5-nitro-imidazol-4-yl)amino]methyl]benzoate CAS Name: 4-[[methyl-(3-methyl-5-nitro-4-imidazolyl)amino]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[methyl-(3-methyl-5-nitroimidazol-4-yl)amino]methyl]benzoate Traditional Name: 4-[[methyl-(3-methyl-5-nitro-imidazol-4-yl)amino]methyl]benzoic acid methyl ester Formula: C14H16N4O4 MolecularWeight: 304.30124

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NC(=C1N(C)CC2=CC=C(C=C2)C(=O)OC)[N+](=O)[O-]

Isomeric SMILES

CN1C=NC(=C1N(C)CC2=CC=C(C=C2)C(=O)OC)[N+](=O)[O-]

InChI

InChI=1S/C14H16N4O4/c1-16(13-12(18(20)21)15-9-17(13)2)8-10-4-6-11(7-5-10)14(19)22-3/h4-7,9H,8H2,1-3H3