methyl-[2-[(4-nitrophenyl)amino]-2-oxidanylidene-ethyl]-(2-phenoxyethyl)azanium

Systemtic Name: methyl-[2-[(4-nitrophenyl)amino]-2-oxidanylidene-ethyl]-(2-phenoxyethyl)azanium Openeye Name: methyl-[2-(4-nitroanilino)-2-oxo-ethyl]-(2-phenoxyethyl)ammonium CAS Name: methyl-[2-(4-nitroanilino)-2-oxoethyl]-(2-phenoxyethyl)ammonium IUPAC Name: methyl-[2-(4-nitroanilino)-2-oxoethyl]-(2-phenoxyethyl)azanium Traditional Name: [2-keto-2-(4-nitroanilino)ethyl]-methyl-(2-phenoxyethyl)ammonium Formula: C17H20N3O4+ MolecularWeight: 330.3584

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CCOC1=CC=CC=C1)CC(=O)NC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

C[NH+](CCOC1=CC=CC=C1)CC(=O)NC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C17H19N3O4/c1-19(11-12-24-16-5-3-2-4-6-16)13-17(21)18-14-7-9-15(10-8-14)20(22)23/h2-10H,11-13H2,1H3,(H,18,21)/p+1