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

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

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CC[NH2+]CC(=O)N)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CC[NH2+]CC(=O)N)OC

InChI

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