[(2S)-butan-2-yl]-[(5-chloranyl-2-oxidanyl-phenyl)methyl]azanium

Systemtic Name: [(2S)-butan-2-yl]-[(5-chloranyl-2-oxidanyl-phenyl)methyl]azanium Openeye Name: (5-chloro-2-hydroxy-phenyl)methyl-[(1S)-1-methylpropyl]ammonium CAS Name: [(2S)-butan-2-yl]-[(5-chloro-2-hydroxyphenyl)methyl]ammonium IUPAC Name: [(2S)-butan-2-yl]-[(5-chloro-2-hydroxyphenyl)methyl]azanium Traditional Name: (5-chloro-2-hydroxy-benzyl)-[(1S)-1-methylpropyl]ammonium Formula: C11H17ClNO+ MolecularWeight: 214.71178

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)[NH2+]CC1=C(C=CC(=C1)Cl)O

Isomeric SMILES

CC[C@H](C)[NH2+]CC1=C(C=CC(=C1)Cl)O

InChI

InChI=1S/C11H16ClNO/c1-3-8(2)13-7-9-6-10(12)4-5-11(9)14/h4-6,8,13-14H,3,7H2,1-2H3/p+1/t8-/m0/s1