[2-[(3,4-diethoxyphenyl)amino]-2-oxidanylidene-ethyl]-[(4-methoxycarbonylphenyl)methyl]-methyl-azanium

Systemtic Name: [2-[(3,4-diethoxyphenyl)amino]-2-oxidanylidene-ethyl]-[(4-methoxycarbonylphenyl)methyl]-methyl-azanium Openeye Name: [2-(3,4-diethoxyanilino)-2-oxo-ethyl]-[(4-methoxycarbonylphenyl)methyl]-methyl-ammonium CAS Name: [2-(3,4-diethoxyanilino)-2-oxoethyl]-[(4-methoxycarbonylphenyl)methyl]-methylammonium IUPAC Name: [2-(3,4-diethoxyanilino)-2-oxoethyl]-[(4-methoxycarbonylphenyl)methyl]-methylazanium Traditional Name: (4-carbomethoxybenzyl)-[2-(3,4-diethoxyanilino)-2-keto-ethyl]-methyl-ammonium Formula: C22H29N2O5+ MolecularWeight: 401.47606

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)NC(=O)C[NH+](C)CC2=CC=C(C=C2)C(=O)OC)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)NC(=O)C[NH+](C)CC2=CC=C(C=C2)C(=O)OC)OCC

InChI

InChI=1S/C22H28N2O5/c1-5-28-19-12-11-18(13-20(19)29-6-2)23-21(25)15-24(3)14-16-7-9-17(10-8-16)22(26)27-4/h7-13H,5-6,14-15H2,1-4H3,(H,23,25)/p+1