[(1R)-2-[(3-chloranyl-1-benzothiophen-2-yl)carbonylamino]-1-(4-methoxyphenyl)ethyl]-dimethyl-azanium

Systemtic Name: [(1R)-2-[(3-chloranyl-1-benzothiophen-2-yl)carbonylamino]-1-(4-methoxyphenyl)ethyl]-dimethyl-azanium Openeye Name: [(1R)-2-[(3-chlorobenzothiophene-2-carbonyl)amino]-1-(4-methoxyphenyl)ethyl]-dimethyl-ammonium CAS Name: [(1R)-2-[[(3-chloro-1-benzothiophen-2-yl)-oxomethyl]amino]-1-(4-methoxyphenyl)ethyl]-dimethylammonium IUPAC Name: [(1R)-2-[(3-chloro-1-benzothiophene-2-carbonyl)amino]-1-(4-methoxyphenyl)ethyl]-dimethylazanium Traditional Name: [(1R)-2-[(3-chlorobenzothiophene-2-carbonyl)amino]-1-(4-methoxyphenyl)ethyl]-dimethyl-ammonium Formula: C20H22ClN2O2S+ MolecularWeight: 389.91888

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)C(CNC(=O)C1=C(C2=CC=CC=C2S1)Cl)C3=CC=C(C=C3)OC

Isomeric SMILES

C[NH+](C)[C@@H](CNC(=O)C1=C(C2=CC=CC=C2S1)Cl)C3=CC=C(C=C3)OC

InChI

InChI=1S/C20H21ClN2O2S/c1-23(2)16(13-8-10-14(25-3)11-9-13)12-22-20(24)19-18(21)15-6-4-5-7-17(15)26-19/h4-11,16H,12H2,1-3H3,(H,22,24)/p+1/t16-/m0/s1