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

Systemtic Name: 4-imidazol-1-yl-N-methyl-N-[(5-methylfuran-2-yl)methyl]-3-nitro-benzamide Openeye Name: 4-imidazol-1-yl-N-methyl-N-[(5-methyl-2-furyl)methyl]-3-nitro-benzamide CAS Name: 4-(1-imidazolyl)-N-methyl-N-[(5-methyl-2-furanyl)methyl]-3-nitrobenzamide IUPAC Name: 4-imidazol-1-yl-N-methyl-N-[(5-methylfuran-2-yl)methyl]-3-nitrobenzamide Traditional Name: 4-imidazol-1-yl-N-methyl-N-[(5-methyl-2-furyl)methyl]-3-nitro-benzamide Formula: C17H16N4O4 MolecularWeight: 340.33334

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)CN(C)C(=O)C2=CC(=C(C=C2)N3C=CN=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(O1)CN(C)C(=O)C2=CC(=C(C=C2)N3C=CN=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H16N4O4/c1-12-3-5-14(25-12)10-19(2)17(22)13-4-6-15(16(9-13)21(23)24)20-8-7-18-11-20/h3-9,11H,10H2,1-2H3