2-(4-chloranylphenoxy)ethyl-[2-[(2,5-diethoxyphenyl)amino]-2-oxidanylidene-ethyl]-methyl-azanium

Systemtic Name: 2-(4-chloranylphenoxy)ethyl-[2-[(2,5-diethoxyphenyl)amino]-2-oxidanylidene-ethyl]-methyl-azanium Openeye Name: 2-(4-chlorophenoxy)ethyl-[2-(2,5-diethoxyanilino)-2-oxo-ethyl]-methyl-ammonium CAS Name: 2-(4-chlorophenoxy)ethyl-[2-(2,5-diethoxyanilino)-2-oxoethyl]-methylammonium IUPAC Name: 2-(4-chlorophenoxy)ethyl-[2-(2,5-diethoxyanilino)-2-oxoethyl]-methylazanium Traditional Name: 2-(4-chlorophenoxy)ethyl-[2-(2,5-diethoxyanilino)-2-keto-ethyl]-methyl-ammonium Formula: C21H28ClN2O4+ MolecularWeight: 407.91102

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=C(C=C1)OCC)NC(=O)C[NH+](C)CCOC2=CC=C(C=C2)Cl

Isomeric SMILES

CCOC1=CC(=C(C=C1)OCC)NC(=O)C[NH+](C)CCOC2=CC=C(C=C2)Cl

InChI

InChI=1S/C21H27ClN2O4/c1-4-26-18-10-11-20(27-5-2)19(14-18)23-21(25)15-24(3)12-13-28-17-8-6-16(22)7-9-17/h6-11,14H,4-5,12-13,15H2,1-3H3,(H,23,25)/p+1