4-(cyclopropylamino)-N-[4-(1-methylimidazol-2-yl)carbonylphenyl]-3-nitro-benzamide

Systemtic Name: 4-(cyclopropylamino)-N-[4-(1-methylimidazol-2-yl)carbonylphenyl]-3-nitro-benzamide Openeye Name: 4-(cyclopropylamino)-N-[4-(1-methylimidazole-2-carbonyl)phenyl]-3-nitro-benzamide CAS Name: 4-(cyclopropylamino)-N-[4-[(1-methyl-2-imidazolyl)-oxomethyl]phenyl]-3-nitrobenzamide IUPAC Name: 4-(cyclopropylamino)-N-[4-(1-methylimidazole-2-carbonyl)phenyl]-3-nitrobenzamide Traditional Name: 4-(cyclopropylamino)-N-[4-(1-methylimidazole-2-carbonyl)phenyl]-3-nitro-benzamide Formula: C21H19N5O4 MolecularWeight: 405.40666

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1C(=O)C2=CC=C(C=C2)NC(=O)C3=CC(=C(C=C3)NC4CC4)[N+](=O)[O-]

Isomeric SMILES

CN1C=CN=C1C(=O)C2=CC=C(C=C2)NC(=O)C3=CC(=C(C=C3)NC4CC4)[N+](=O)[O-]

InChI

InChI=1S/C21H19N5O4/c1-25-11-10-22-20(25)19(27)13-2-5-16(6-3-13)24-21(28)14-4-9-17(23-15-7-8-15)18(12-14)26(29)30/h2-6,9-12,15,23H,7-8H2,1H3,(H,24,28)