2-(2-chloranyl-3,4-dimethoxy-phenyl)ethyl-[(2S)-2-(4-methoxyphenyl)-2-oxidanyl-ethyl]azanium

Systemtic Name: 2-(2-chloranyl-3,4-dimethoxy-phenyl)ethyl-[(2S)-2-(4-methoxyphenyl)-2-oxidanyl-ethyl]azanium Openeye Name: 2-(2-chloro-3,4-dimethoxy-phenyl)ethyl-[(2S)-2-hydroxy-2-(4-methoxyphenyl)ethyl]ammonium CAS Name: 2-(2-chloro-3,4-dimethoxyphenyl)ethyl-[(2S)-2-hydroxy-2-(4-methoxyphenyl)ethyl]ammonium IUPAC Name: 2-(2-chloro-3,4-dimethoxyphenyl)ethyl-[(2S)-2-hydroxy-2-(4-methoxyphenyl)ethyl]azanium Traditional Name: 2-(2-chloro-3,4-dimethoxy-phenyl)ethyl-[(2S)-2-hydroxy-2-(4-methoxyphenyl)ethyl]ammonium Formula: C19H25ClNO4+ MolecularWeight: 366.8591

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(C[NH2+]CCC2=C(C(=C(C=C2)OC)OC)Cl)O

Isomeric SMILES

COC1=CC=C(C=C1)[C@@H](C[NH2+]CCC2=C(C(=C(C=C2)OC)OC)Cl)O

InChI

InChI=1S/C19H24ClNO4/c1-23-15-7-4-13(5-8-15)16(22)12-21-11-10-14-6-9-17(24-2)19(25-3)18(14)20/h4-9,16,21-22H,10-12H2,1-3H3/p+1/t16-/m1/s1