[(1S,2S)-1-(3-chloranyl-4-methoxy-phenyl)-2-methyl-butyl]azanium

Systemtic Name: [(1S,2S)-1-(3-chloranyl-4-methoxy-phenyl)-2-methyl-butyl]azanium Openeye Name: [(1S,2S)-1-(3-chloro-4-methoxy-phenyl)-2-methyl-butyl]ammonium CAS Name: [(1S,2S)-1-(3-chloro-4-methoxyphenyl)-2-methylbutyl]ammonium IUPAC Name: [(1S,2S)-1-(3-chloro-4-methoxyphenyl)-2-methylbutyl]azanium Traditional Name: [(1S,2S)-1-(3-chloro-4-methoxy-phenyl)-2-methyl-butyl]ammonium Formula: C12H19ClNO+ MolecularWeight: 228.73836

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C1=CC(=C(C=C1)OC)Cl)[NH3+]

Isomeric SMILES

CC[C@H](C)[C@@H](C1=CC(=C(C=C1)OC)Cl)[NH3+]

InChI

InChI=1S/C12H18ClNO/c1-4-8(2)12(14)9-5-6-11(15-3)10(13)7-9/h5-8,12H,4,14H2,1-3H3/p+1/t8-,12-/m0/s1