3-bromanyl-4-ethoxy-aniline; 2-(3,4-dimethoxyphenyl)-N-methyl-ethanamine

Systemtic Name: 3-bromanyl-4-ethoxy-aniline; 2-(3,4-dimethoxyphenyl)-N-methyl-ethanamine Openeye Name: 3-bromo-4-ethoxy-aniline; 2-(3,4-dimethoxyphenyl)-N-methyl-ethanamine CAS Name: 3-bromo-4-ethoxyaniline; 2-(3,4-dimethoxyphenyl)-N-methylethanamine IUPAC Name: 3-bromo-4-ethoxyaniline; 2-(3,4-dimethoxyphenyl)-N-methylethanamine Traditional Name: (3-bromo-4-ethoxy-phenyl)amine; homoveratryl(methyl)amine Formula: C19H27BrN2O3 MolecularWeight: 411.33328

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)N)Br.CNCCC1=CC(=C(C=C1)OC)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1)N)Br.CNCCC1=CC(=C(C=C1)OC)OC

InChI

InChI=1S/C11H17NO2.C8H10BrNO/c1-12-7-6-9-4-5-10(13-2)11(8-9)14-3;1-2-11-8-4-3-6(10)5-7(8)9/h4-5,8,12H,6-7H2,1-3H3;3-5H,2,10H2,1H3