N-[5-(cyclopropylcarbonylamino)-2-methyl-phenyl]-4-imidazol-1-yl-3-nitro-benzamide

Systemtic Name: N-[5-(cyclopropylcarbonylamino)-2-methyl-phenyl]-4-imidazol-1-yl-3-nitro-benzamide Openeye Name: N-[5-(cyclopropanecarbonylamino)-2-methyl-phenyl]-4-imidazol-1-yl-3-nitro-benzamide CAS Name: N-[5-[[cyclopropyl(oxo)methyl]amino]-2-methylphenyl]-4-(1-imidazolyl)-3-nitrobenzamide IUPAC Name: N-[5-(cyclopropanecarbonylamino)-2-methylphenyl]-4-imidazol-1-yl-3-nitrobenzamide Traditional Name: N-[5-(cyclopropanecarbonylamino)-2-methyl-phenyl]-4-imidazol-1-yl-3-nitro-benzamide Formula: C21H19N5O4 MolecularWeight: 405.40666

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2CC2)NC(=O)C3=CC(=C(C=C3)N4C=CN=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2CC2)NC(=O)C3=CC(=C(C=C3)N4C=CN=C4)[N+](=O)[O-]

InChI

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