(3-bromanyl-5-methoxy-4-prop-2-enoxy-phenyl)methyl-(2,4,4-trimethylpentan-2-yl)azanium

Systemtic Name: (3-bromanyl-5-methoxy-4-prop-2-enoxy-phenyl)methyl-(2,4,4-trimethylpentan-2-yl)azanium Openeye Name: (4-allyloxy-3-bromo-5-methoxy-phenyl)methyl-(1,1,3,3-tetramethylbutyl)ammonium CAS Name: (3-bromo-5-methoxy-4-prop-2-enoxyphenyl)methyl-(2,4,4-trimethylpentan-2-yl)ammonium IUPAC Name: (3-bromo-5-methoxy-4-prop-2-enoxyphenyl)methyl-(2,4,4-trimethylpentan-2-yl)azanium Traditional Name: (4-allyloxy-3-bromo-5-methoxy-benzyl)-(1,1,3,3-tetramethylbutyl)ammonium Formula: C19H31BrNO2+ MolecularWeight: 385.35894

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H30BrNO2/c1-8-9-23-17-15(20)10-14(11-16(17)22-7)12-21-19(5,6)13-18(2,3)4/h8,10-11,21H,1,9,12-13H2,2-7H3/p+1