(3-bromanyl-5-methoxy-4-oxidanyl-phenyl)methyl-[2-[di(propan-2-yl)amino]ethyl]azanium

Systemtic Name: (3-bromanyl-5-methoxy-4-oxidanyl-phenyl)methyl-[2-[di(propan-2-yl)amino]ethyl]azanium Openeye Name: (3-bromo-4-hydroxy-5-methoxy-phenyl)methyl-[2-(diisopropylamino)ethyl]ammonium CAS Name: (3-bromo-4-hydroxy-5-methoxyphenyl)methyl-[2-[di(propan-2-yl)amino]ethyl]ammonium IUPAC Name: (3-bromo-4-hydroxy-5-methoxyphenyl)methyl-[2-[di(propan-2-yl)amino]ethyl]azanium Traditional Name: (3-bromo-4-hydroxy-5-methoxy-benzyl)-[2-(diisopropylamino)ethyl]ammonium Formula: C16H28BrN2O2+ MolecularWeight: 360.30972

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H27BrN2O2/c1-11(2)19(12(3)4)7-6-18-10-13-8-14(17)16(20)15(9-13)21-5/h8-9,11-12,18,20H,6-7,10H2,1-5H3/p+1