[7-[(4-methyl-3-nitro-phenyl)amino]-7-oxidanylidene-heptyl]azanium

Systemtic Name: [7-[(4-methyl-3-nitro-phenyl)amino]-7-oxidanylidene-heptyl]azanium Openeye Name: [7-(4-methyl-3-nitro-anilino)-7-oxo-heptyl]ammonium CAS Name: [7-(4-methyl-3-nitroanilino)-7-oxoheptyl]ammonium IUPAC Name: [7-(4-methyl-3-nitroanilino)-7-oxoheptyl]azanium Traditional Name: [7-keto-7-(4-methyl-3-nitro-anilino)heptyl]ammonium Formula: C14H22N3O3+ MolecularWeight: 280.34278

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H21N3O3/c1-11-7-8-12(10-13(11)17(19)20)16-14(18)6-4-2-3-5-9-15/h7-8,10H,2-6,9,15H2,1H3,(H,16,18)/p+1