[2-[(2,3-dimethyl-6-nitro-phenyl)amino]-2-oxidanylidene-ethyl]-methyl-[(5-methylfuran-2-yl)methyl]azanium

Systemtic Name: [2-[(2,3-dimethyl-6-nitro-phenyl)amino]-2-oxidanylidene-ethyl]-methyl-[(5-methylfuran-2-yl)methyl]azanium Openeye Name: [2-(2,3-dimethyl-6-nitro-anilino)-2-oxo-ethyl]-methyl-[(5-methyl-2-furyl)methyl]ammonium CAS Name: [2-(2,3-dimethyl-6-nitroanilino)-2-oxoethyl]-methyl-[(5-methyl-2-furanyl)methyl]ammonium IUPAC Name: [2-(2,3-dimethyl-6-nitroanilino)-2-oxoethyl]-methyl-[(5-methylfuran-2-yl)methyl]azanium Traditional Name: [2-(2,3-dimethyl-6-nitro-anilino)-2-keto-ethyl]-methyl-[(5-methyl-2-furyl)methyl]ammonium Formula: C17H22N3O4+ MolecularWeight: 332.37428

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1)[N+](=O)[O-])NC(=O)C[NH+](C)CC2=CC=C(O2)C)C

Isomeric SMILES

CC1=C(C(=C(C=C1)[N+](=O)[O-])NC(=O)C[NH+](C)CC2=CC=C(O2)C)C

InChI

InChI=1S/C17H21N3O4/c1-11-5-8-15(20(22)23)17(13(11)3)18-16(21)10-19(4)9-14-7-6-12(2)24-14/h5-8H,9-10H2,1-4H3,(H,18,21)/p+1