(4-ethylphenyl)methyl-[2-[(5-methoxycarbonyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-methyl-azanium

Systemtic Name: (4-ethylphenyl)methyl-[2-[(5-methoxycarbonyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-methyl-azanium Openeye Name: (4-ethylphenyl)methyl-[2-(5-methoxycarbonyl-2-methyl-anilino)-2-oxo-ethyl]-methyl-ammonium CAS Name: (4-ethylphenyl)methyl-[2-(5-methoxycarbonyl-2-methylanilino)-2-oxoethyl]-methylammonium IUPAC Name: (4-ethylphenyl)methyl-[2-(5-methoxycarbonyl-2-methylanilino)-2-oxoethyl]-methylazanium Traditional Name: [2-(5-carbomethoxy-2-methyl-anilino)-2-keto-ethyl]-(4-ethylbenzyl)-methyl-ammonium Formula: C21H27N2O3+ MolecularWeight: 355.45068

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H26N2O3/c1-5-16-7-9-17(10-8-16)13-23(3)14-20(24)22-19-12-18(21(25)26-4)11-6-15(19)2/h6-12H,5,13-14H2,1-4H3,(H,22,24)/p+1