[2-[2-(3,4-dimethoxyphenyl)ethylamino]-2-oxidanylidene-ethyl]azanium

Systemtic Name: [2-[2-(3,4-dimethoxyphenyl)ethylamino]-2-oxidanylidene-ethyl]azanium Openeye Name: [2-[2-(3,4-dimethoxyphenyl)ethylamino]-2-oxo-ethyl]ammonium CAS Name: [2-[2-(3,4-dimethoxyphenyl)ethylamino]-2-oxoethyl]ammonium IUPAC Name: [2-[2-(3,4-dimethoxyphenyl)ethylamino]-2-oxoethyl]azanium Traditional Name: [2-(homoveratrylamino)-2-keto-ethyl]ammonium Formula: C12H19N2O3+ MolecularWeight: 239.29086

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNC(=O)C[NH3+])OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNC(=O)C[NH3+])OC

InChI

InChI=1S/C12H18N2O3/c1-16-10-4-3-9(7-11(10)17-2)5-6-14-12(15)8-13/h3-4,7H,5-6,8,13H2,1-2H3,(H,14,15)/p+1