[(1S)-2-azaniumyl-1-(3-chloranyl-5-methoxy-4-oxidanyl-phenyl)ethyl]-cyclohexyl-ethyl-azanium

Systemtic Name: [(1S)-2-azaniumyl-1-(3-chloranyl-5-methoxy-4-oxidanyl-phenyl)ethyl]-cyclohexyl-ethyl-azanium Openeye Name: [(1S)-2-azaniumyl-1-(3-chloro-4-hydroxy-5-methoxy-phenyl)ethyl]-cyclohexyl-ethyl-ammonium CAS Name: [(1S)-2-ammonio-1-(3-chloro-4-hydroxy-5-methoxyphenyl)ethyl]-cyclohexyl-ethylammonium IUPAC Name: [(1S)-2-azaniumyl-1-(3-chloro-4-hydroxy-5-methoxyphenyl)ethyl]-cyclohexyl-ethylazanium Traditional Name: [(1S)-2-ammonio-1-(3-chloro-4-hydroxy-5-methoxy-phenyl)ethyl]-cyclohexyl-ethyl-ammonium Formula: C17H29ClN2O2+2 MolecularWeight: 328.87736

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](C1CCCCC1)C(C[NH3+])C2=CC(=C(C(=C2)Cl)O)OC

Isomeric SMILES

CC[NH+](C1CCCCC1)[C@H](C[NH3+])C2=CC(=C(C(=C2)Cl)O)OC

InChI

InChI=1S/C17H27ClN2O2/c1-3-20(13-7-5-4-6-8-13)15(11-19)12-9-14(18)17(21)16(10-12)22-2/h9-10,13,15,21H,3-8,11,19H2,1-2H3/p+2/t15-/m1/s1