[4-[(4-methyl-3-nitro-phenyl)amino]-4-oxidanylidene-butyl]azanium

Systemtic Name: [4-[(4-methyl-3-nitro-phenyl)amino]-4-oxidanylidene-butyl]azanium Openeye Name: [4-(4-methyl-3-nitro-anilino)-4-oxo-butyl]ammonium CAS Name: [4-(4-methyl-3-nitroanilino)-4-oxobutyl]ammonium IUPAC Name: [4-(4-methyl-3-nitroanilino)-4-oxobutyl]azanium Traditional Name: [4-keto-4-(4-methyl-3-nitro-anilino)butyl]ammonium Formula: C11H16N3O3+ MolecularWeight: 238.26304

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)CCC[NH3+])[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)CCC[NH3+])[N+](=O)[O-]

InChI

InChI=1S/C11H15N3O3/c1-8-4-5-9(7-10(8)14(16)17)13-11(15)3-2-6-12/h4-5,7H,2-3,6,12H2,1H3,(H,13,15)/p+1