(3-bromanyl-5-methoxy-4-oxidanyl-phenyl)methyl-(3-propan-2-yloxypropyl)azanium

Systemtic Name: (3-bromanyl-5-methoxy-4-oxidanyl-phenyl)methyl-(3-propan-2-yloxypropyl)azanium Openeye Name: (3-bromo-4-hydroxy-5-methoxy-phenyl)methyl-(3-isopropoxypropyl)ammonium CAS Name: (3-bromo-4-hydroxy-5-methoxyphenyl)methyl-(3-propan-2-yloxypropyl)ammonium IUPAC Name: (3-bromo-4-hydroxy-5-methoxyphenyl)methyl-(3-propan-2-yloxypropyl)azanium Traditional Name: (3-bromo-4-hydroxy-5-methoxy-benzyl)-(3-isopropoxypropyl)ammonium Formula: C14H23BrNO3+ MolecularWeight: 333.24132

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H22BrNO3/c1-10(2)19-6-4-5-16-9-11-7-12(15)14(17)13(8-11)18-3/h7-8,10,16-17H,4-6,9H2,1-3H3/p+1