3-methyl-N-[(5-methylfuran-2-yl)methyl]-4-(3-nitrophenyl)-1H-imidazol-3-ium-2-amine

Systemtic Name: 3-methyl-N-[(5-methylfuran-2-yl)methyl]-4-(3-nitrophenyl)-1H-imidazol-3-ium-2-amine Openeye Name: 3-methyl-N-[(5-methyl-2-furyl)methyl]-4-(3-nitrophenyl)-1H-imidazol-3-ium-2-amine CAS Name: 3-methyl-N-[(5-methyl-2-furanyl)methyl]-4-(3-nitrophenyl)-1H-imidazol-3-ium-2-amine IUPAC Name: 3-methyl-N-[(5-methylfuran-2-yl)methyl]-4-(3-nitrophenyl)-1H-imidazol-3-ium-2-amine Traditional Name: (5-methyl-2-furyl)methyl-[3-methyl-4-(3-nitrophenyl)-1H-imidazol-3-ium-2-yl]amine Formula: C16H17N4O3+ MolecularWeight: 313.33118

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)CNC2=[N+](C(=CN2)C3=CC(=CC=C3)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC=C(O1)CNC2=[N+](C(=CN2)C3=CC(=CC=C3)[N+](=O)[O-])C

InChI

InChI=1S/C16H16N4O3/c1-11-6-7-14(23-11)9-17-16-18-10-15(19(16)2)12-4-3-5-13(8-12)20(21)22/h3-8,10H,9H2,1-2H3,(H,17,18)/p+1