(3-bromanyl-5-methoxy-4-oxidanyl-phenyl)methyl-(1-propan-2-ylpiperidin-4-yl)azanium

Systemtic Name: (3-bromanyl-5-methoxy-4-oxidanyl-phenyl)methyl-(1-propan-2-ylpiperidin-4-yl)azanium Openeye Name: (3-bromo-4-hydroxy-5-methoxy-phenyl)methyl-(1-isopropyl-4-piperidyl)ammonium CAS Name: (3-bromo-4-hydroxy-5-methoxyphenyl)methyl-(1-propan-2-yl-4-piperidinyl)ammonium IUPAC Name: (3-bromo-4-hydroxy-5-methoxyphenyl)methyl-(1-propan-2-ylpiperidin-4-yl)azanium Traditional Name: (3-bromo-4-hydroxy-5-methoxy-benzyl)-(1-isopropyl-4-piperidyl)ammonium Formula: C16H26BrN2O2+ MolecularWeight: 358.29384

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1CCC(CC1)[NH2+]CC2=CC(=C(C(=C2)Br)O)OC

Isomeric SMILES

CC(C)N1CCC(CC1)[NH2+]CC2=CC(=C(C(=C2)Br)O)OC

InChI

InChI=1S/C16H25BrN2O2/c1-11(2)19-6-4-13(5-7-19)18-10-12-8-14(17)16(20)15(9-12)21-3/h8-9,11,13,18,20H,4-7,10H2,1-3H3/p+1