(3-bromanyl-5-ethoxy-4-methoxy-phenyl)methyl-ethyl-azanium

Systemtic Name: (3-bromanyl-5-ethoxy-4-methoxy-phenyl)methyl-ethyl-azanium Openeye Name: (3-bromo-5-ethoxy-4-methoxy-phenyl)methyl-ethyl-ammonium CAS Name: (3-bromo-5-ethoxy-4-methoxyphenyl)methyl-ethylammonium IUPAC Name: (3-bromo-5-ethoxy-4-methoxyphenyl)methyl-ethylazanium Traditional Name: (3-bromo-5-ethoxy-4-methoxy-benzyl)-ethyl-ammonium Formula: C12H19BrNO2+ MolecularWeight: 289.18876

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH2+]CC1=CC(=C(C(=C1)Br)OC)OCC

Isomeric SMILES

CC[NH2+]CC1=CC(=C(C(=C1)Br)OC)OCC

InChI

InChI=1S/C12H18BrNO2/c1-4-14-8-9-6-10(13)12(15-3)11(7-9)16-5-2/h6-7,14H,4-5,8H2,1-3H3/p+1