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

Systemtic Name: [2-[(2-methylphenyl)amino]-2-oxidanylidene-ethyl]-[(4-nitrophenyl)methyl]-propyl-azanium Openeye Name: [2-(2-methylanilino)-2-oxo-ethyl]-[(4-nitrophenyl)methyl]-propyl-ammonium CAS Name: [2-(2-methylanilino)-2-oxoethyl]-[(4-nitrophenyl)methyl]-propylammonium IUPAC Name: [2-(2-methylanilino)-2-oxoethyl]-[(4-nitrophenyl)methyl]-propylazanium Traditional Name: [2-keto-2-(o-toluidino)ethyl]-(4-nitrobenzyl)-propyl-ammonium Formula: C19H24N3O3+ MolecularWeight: 342.41216

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Descriptors Computed from Structure

Canonical SMILES:

CCC[NH+](CC1=CC=C(C=C1)[N+](=O)[O-])CC(=O)NC2=CC=CC=C2C

Isomeric SMILES

CCC[NH+](CC1=CC=C(C=C1)[N+](=O)[O-])CC(=O)NC2=CC=CC=C2C

InChI

InChI=1S/C19H23N3O3/c1-3-12-21(13-16-8-10-17(11-9-16)22(24)25)14-19(23)20-18-7-5-4-6-15(18)2/h4-11H,3,12-14H2,1-2H3,(H,20,23)/p+1