2-(4-chlorophenyl)ethyl-[(1S)-1-(4-methoxy-2-oxidanyl-phenyl)ethyl]azanium

Systemtic Name: 2-(4-chlorophenyl)ethyl-[(1S)-1-(4-methoxy-2-oxidanyl-phenyl)ethyl]azanium Openeye Name: 2-(4-chlorophenyl)ethyl-[(1S)-1-(2-hydroxy-4-methoxy-phenyl)ethyl]ammonium CAS Name: 2-(4-chlorophenyl)ethyl-[(1S)-1-(2-hydroxy-4-methoxyphenyl)ethyl]ammonium IUPAC Name: 2-(4-chlorophenyl)ethyl-[(1S)-1-(2-hydroxy-4-methoxyphenyl)ethyl]azanium Traditional Name: 2-(4-chlorophenyl)ethyl-[(1S)-1-(2-hydroxy-4-methoxy-phenyl)ethyl]ammonium Formula: C17H21ClNO2+ MolecularWeight: 306.80714

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=C(C=C(C=C1)OC)O)[NH2+]CCC2=CC=C(C=C2)Cl

Isomeric SMILES

C[C@@H](C1=C(C=C(C=C1)OC)O)[NH2+]CCC2=CC=C(C=C2)Cl

InChI

InChI=1S/C17H20ClNO2/c1-12(16-8-7-15(21-2)11-17(16)20)19-10-9-13-3-5-14(18)6-4-13/h3-8,11-12,19-20H,9-10H2,1-2H3/p+1/t12-/m0/s1