2-(3,4-dimethoxyphenyl)ethyl-[2-[(5-methoxycarbonyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-methyl-azanium

Systemtic Name: 2-(3,4-dimethoxyphenyl)ethyl-[2-[(5-methoxycarbonyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-methyl-azanium Openeye Name: 2-(3,4-dimethoxyphenyl)ethyl-[2-(5-methoxycarbonyl-2-methyl-anilino)-2-oxo-ethyl]-methyl-ammonium CAS Name: 2-(3,4-dimethoxyphenyl)ethyl-[2-(5-methoxycarbonyl-2-methylanilino)-2-oxoethyl]-methylammonium IUPAC Name: 2-(3,4-dimethoxyphenyl)ethyl-[2-(5-methoxycarbonyl-2-methylanilino)-2-oxoethyl]-methylazanium Traditional Name: [2-(5-carbomethoxy-2-methyl-anilino)-2-keto-ethyl]-homoveratryl-methyl-ammonium Formula: C22H29N2O5+ MolecularWeight: 401.47606

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)C[NH+](C)CCC2=CC(=C(C=C2)OC)OC

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)C[NH+](C)CCC2=CC(=C(C=C2)OC)OC

InChI

InChI=1S/C22H28N2O5/c1-15-6-8-17(22(26)29-5)13-18(15)23-21(25)14-24(2)11-10-16-7-9-19(27-3)20(12-16)28-4/h6-9,12-13H,10-11,14H2,1-5H3,(H,23,25)/p+1