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

Systemtic Name: 2-cyanoethyl-[2-[(3,4-diethoxyphenyl)amino]-2-oxidanylidene-ethyl]-methyl-azanium Openeye Name: 2-cyanoethyl-[2-(3,4-diethoxyanilino)-2-oxo-ethyl]-methyl-ammonium CAS Name: 2-cyanoethyl-[2-(3,4-diethoxyanilino)-2-oxoethyl]-methylammonium IUPAC Name: 2-cyanoethyl-[2-(3,4-diethoxyanilino)-2-oxoethyl]-methylazanium Traditional Name: 2-cyanoethyl-[2-(3,4-diethoxyanilino)-2-keto-ethyl]-methyl-ammonium Formula: C16H24N3O3+ MolecularWeight: 306.38006

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)NC(=O)C[NH+](C)CCC#N)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)NC(=O)C[NH+](C)CCC#N)OCC

InChI

InChI=1S/C16H23N3O3/c1-4-21-14-8-7-13(11-15(14)22-5-2)18-16(20)12-19(3)10-6-9-17/h7-8,11H,4-6,10,12H2,1-3H3,(H,18,20)/p+1