[3-bromanyl-4-[(4-chlorophenyl)methoxy]phenyl]methyl-[(2S)-butan-2-yl]azanium

Systemtic Name: [3-bromanyl-4-[(4-chlorophenyl)methoxy]phenyl]methyl-[(2S)-butan-2-yl]azanium Openeye Name: [3-bromo-4-[(4-chlorophenyl)methoxy]phenyl]methyl-[(1S)-1-methylpropyl]ammonium CAS Name: [3-bromo-4-[(4-chlorophenyl)methoxy]phenyl]methyl-[(2S)-butan-2-yl]ammonium IUPAC Name: [3-bromo-4-[(4-chlorophenyl)methoxy]phenyl]methyl-[(2S)-butan-2-yl]azanium Traditional Name: [3-bromo-4-(4-chlorobenzyl)oxy-benzyl]-[(1S)-1-methylpropyl]ammonium Formula: C18H22BrClNO+ MolecularWeight: 383.73038

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H21BrClNO/c1-3-13(2)21-11-15-6-9-18(17(19)10-15)22-12-14-4-7-16(20)8-5-14/h4-10,13,21H,3,11-12H2,1-2H3/p+1/t13-/m0/s1