[2-[(4,5-dimethyl-2-nitro-phenyl)amino]-2-oxidanylidene-ethyl]-(furan-2-ylmethyl)-methyl-azanium

Systemtic Name: [2-[(4,5-dimethyl-2-nitro-phenyl)amino]-2-oxidanylidene-ethyl]-(furan-2-ylmethyl)-methyl-azanium Openeye Name: [2-(4,5-dimethyl-2-nitro-anilino)-2-oxo-ethyl]-(2-furylmethyl)-methyl-ammonium CAS Name: [2-(4,5-dimethyl-2-nitroanilino)-2-oxoethyl]-(2-furanylmethyl)-methylammonium IUPAC Name: [2-(4,5-dimethyl-2-nitroanilino)-2-oxoethyl]-(furan-2-ylmethyl)-methylazanium Traditional Name: [2-(4,5-dimethyl-2-nitro-anilino)-2-keto-ethyl]-(2-furfuryl)-methyl-ammonium Formula: C16H20N3O4+ MolecularWeight: 318.3477

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C)[N+](=O)[O-])NC(=O)C[NH+](C)CC2=CC=CO2

Isomeric SMILES

CC1=CC(=C(C=C1C)[N+](=O)[O-])NC(=O)C[NH+](C)CC2=CC=CO2

InChI

InChI=1S/C16H19N3O4/c1-11-7-14(15(19(21)22)8-12(11)2)17-16(20)10-18(3)9-13-5-4-6-23-13/h4-8H,9-10H2,1-3H3,(H,17,20)/p+1