(3-bromanyl-5-ethoxy-4-methoxy-phenyl)methyl-(2-diethylaminoethyl)azanium

Systemtic Name: (3-bromanyl-5-ethoxy-4-methoxy-phenyl)methyl-(2-diethylaminoethyl)azanium Openeye Name: (3-bromo-5-ethoxy-4-methoxy-phenyl)methyl-(2-diethylaminoethyl)ammonium CAS Name: (3-bromo-5-ethoxy-4-methoxyphenyl)methyl-(2-diethylaminoethyl)ammonium IUPAC Name: (3-bromo-5-ethoxy-4-methoxyphenyl)methyl-(2-diethylaminoethyl)azanium Traditional Name: (3-bromo-5-ethoxy-4-methoxy-benzyl)-(2-diethylaminoethyl)ammonium Formula: C16H28BrN2O2+ MolecularWeight: 360.30972

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H27BrN2O2/c1-5-19(6-2)9-8-18-12-13-10-14(17)16(20-4)15(11-13)21-7-3/h10-11,18H,5-9,12H2,1-4H3/p+1