(5-ethanoyl-2-ethoxy-phenyl)methyl-[2-[(2-methylphenyl)amino]-2-oxidanylidene-ethyl]-propyl-azanium

Systemtic Name: (5-ethanoyl-2-ethoxy-phenyl)methyl-[2-[(2-methylphenyl)amino]-2-oxidanylidene-ethyl]-propyl-azanium Openeye Name: (5-acetyl-2-ethoxy-phenyl)methyl-[2-(2-methylanilino)-2-oxo-ethyl]-propyl-ammonium CAS Name: (5-acetyl-2-ethoxyphenyl)methyl-[2-(2-methylanilino)-2-oxoethyl]-propylammonium IUPAC Name: (5-acetyl-2-ethoxyphenyl)methyl-[2-(2-methylanilino)-2-oxoethyl]-propylazanium Traditional Name: (5-acetyl-2-ethoxy-benzyl)-[2-keto-2-(o-toluidino)ethyl]-propyl-ammonium Formula: C23H31N2O3+ MolecularWeight: 383.50384

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H30N2O3/c1-5-13-25(16-23(27)24-21-10-8-7-9-17(21)3)15-20-14-19(18(4)26)11-12-22(20)28-6-2/h7-12,14H,5-6,13,15-16H2,1-4H3,(H,24,27)/p+1