(3-bromanyl-5-ethoxy-4-propan-2-yloxy-phenyl)methyl-(2-methyl-1-oxidanyl-propan-2-yl)azanium

Systemtic Name: (3-bromanyl-5-ethoxy-4-propan-2-yloxy-phenyl)methyl-(2-methyl-1-oxidanyl-propan-2-yl)azanium Openeye Name: (3-bromo-5-ethoxy-4-isopropoxy-phenyl)methyl-(2-hydroxy-1,1-dimethyl-ethyl)ammonium CAS Name: (3-bromo-5-ethoxy-4-propan-2-yloxyphenyl)methyl-(1-hydroxy-2-methylpropan-2-yl)ammonium IUPAC Name: (3-bromo-5-ethoxy-4-propan-2-yloxyphenyl)methyl-(1-hydroxy-2-methylpropan-2-yl)azanium Traditional Name: (3-bromo-5-ethoxy-4-isopropoxy-benzyl)-(2-hydroxy-1,1-dimethyl-ethyl)ammonium Formula: C16H27BrNO3+ MolecularWeight: 361.29448

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C[NH2+]C(C)(C)CO)Br)OC(C)C

Isomeric SMILES

CCOC1=C(C(=CC(=C1)C[NH2+]C(C)(C)CO)Br)OC(C)C

InChI

InChI=1S/C16H26BrNO3/c1-6-20-14-8-12(9-18-16(4,5)10-19)7-13(17)15(14)21-11(2)3/h7-8,11,18-19H,6,9-10H2,1-5H3/p+1