[(1S)-1-[4-(4-chloranyl-2,6-dimethyl-phenoxy)phenyl]ethyl]azanium

Systemtic Name: [(1S)-1-[4-(4-chloranyl-2,6-dimethyl-phenoxy)phenyl]ethyl]azanium Openeye Name: [(1S)-1-[4-(4-chloro-2,6-dimethyl-phenoxy)phenyl]ethyl]ammonium CAS Name: [(1S)-1-[4-(4-chloro-2,6-dimethylphenoxy)phenyl]ethyl]ammonium IUPAC Name: [(1S)-1-[4-(4-chloro-2,6-dimethylphenoxy)phenyl]ethyl]azanium Traditional Name: [(1S)-1-[4-(4-chloro-2,6-dimethyl-phenoxy)phenyl]ethyl]ammonium Formula: C16H19ClNO+ MolecularWeight: 276.78116

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1OC2=CC=C(C=C2)C(C)[NH3+])C)Cl

Isomeric SMILES

CC1=CC(=CC(=C1OC2=CC=C(C=C2)[C@H](C)[NH3+])C)Cl

InChI

InChI=1S/C16H18ClNO/c1-10-8-14(17)9-11(2)16(10)19-15-6-4-13(5-7-15)12(3)18/h4-9,12H,18H2,1-3H3/p+1/t12-/m0/s1