[5-bromanyl-2-[(4-chlorophenyl)methoxy]phenyl]methyl-[(2R)-1-oxidanylbutan-2-yl]azanium

Systemtic Name: [5-bromanyl-2-[(4-chlorophenyl)methoxy]phenyl]methyl-[(2R)-1-oxidanylbutan-2-yl]azanium Openeye Name: [5-bromo-2-[(4-chlorophenyl)methoxy]phenyl]methyl-[(1R)-1-(hydroxymethyl)propyl]ammonium CAS Name: [5-bromo-2-[(4-chlorophenyl)methoxy]phenyl]methyl-[(2R)-1-hydroxybutan-2-yl]ammonium IUPAC Name: [5-bromo-2-[(4-chlorophenyl)methoxy]phenyl]methyl-[(2R)-1-hydroxybutan-2-yl]azanium Traditional Name: [5-bromo-2-(4-chlorobenzyl)oxy-benzyl]-[(1R)-1-methylolpropyl]ammonium Formula: C18H22BrClNO2+ MolecularWeight: 399.72978

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CO)[NH2+]CC1=C(C=CC(=C1)Br)OCC2=CC=C(C=C2)Cl

Isomeric SMILES

CC[C@H](CO)[NH2+]CC1=C(C=CC(=C1)Br)OCC2=CC=C(C=C2)Cl

InChI

InChI=1S/C18H21BrClNO2/c1-2-17(11-22)21-10-14-9-15(19)5-8-18(14)23-12-13-3-6-16(20)7-4-13/h3-9,17,21-22H,2,10-12H2,1H3/p+1/t17-/m1/s1