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

Systemtic Name: (4-ethylphenyl)methyl-methyl-[2-[(2-nitrophenyl)amino]-2-oxidanylidene-ethyl]azanium Openeye Name: (4-ethylphenyl)methyl-methyl-[2-(2-nitroanilino)-2-oxo-ethyl]ammonium CAS Name: (4-ethylphenyl)methyl-methyl-[2-(2-nitroanilino)-2-oxoethyl]ammonium IUPAC Name: (4-ethylphenyl)methyl-methyl-[2-(2-nitroanilino)-2-oxoethyl]azanium Traditional Name: (4-ethylbenzyl)-[2-keto-2-(2-nitroanilino)ethyl]-methyl-ammonium Formula: C18H22N3O3+ MolecularWeight: 328.38558

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C[NH+](C)CC(=O)NC2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

CCC1=CC=C(C=C1)C[NH+](C)CC(=O)NC2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C18H21N3O3/c1-3-14-8-10-15(11-9-14)12-20(2)13-18(22)19-16-6-4-5-7-17(16)21(23)24/h4-11H,3,12-13H2,1-2H3,(H,19,22)/p+1