[(1R)-2-[(3-chloranyl-6-methyl-1-benzothiophen-2-yl)carbonylamino]-1-(4-methoxyphenyl)ethyl]-dimethyl-azanium

Systemtic Name: [(1R)-2-[(3-chloranyl-6-methyl-1-benzothiophen-2-yl)carbonylamino]-1-(4-methoxyphenyl)ethyl]-dimethyl-azanium Openeye Name: [(1R)-2-[(3-chloro-6-methyl-benzothiophene-2-carbonyl)amino]-1-(4-methoxyphenyl)ethyl]-dimethyl-ammonium CAS Name: [(1R)-2-[[(3-chloro-6-methyl-1-benzothiophen-2-yl)-oxomethyl]amino]-1-(4-methoxyphenyl)ethyl]-dimethylammonium IUPAC Name: [(1R)-2-[(3-chloro-6-methyl-1-benzothiophene-2-carbonyl)amino]-1-(4-methoxyphenyl)ethyl]-dimethylazanium Traditional Name: [(1R)-2-[(3-chloro-6-methyl-benzothiophene-2-carbonyl)amino]-1-(4-methoxyphenyl)ethyl]-dimethyl-ammonium Formula: C21H24ClN2O2S+ MolecularWeight: 403.94546

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=C(S2)C(=O)NCC(C3=CC=C(C=C3)OC)[NH+](C)C)Cl

Isomeric SMILES

CC1=CC2=C(C=C1)C(=C(S2)C(=O)NC[C@@H](C3=CC=C(C=C3)OC)[NH+](C)C)Cl

InChI

InChI=1S/C21H23ClN2O2S/c1-13-5-10-16-18(11-13)27-20(19(16)22)21(25)23-12-17(24(2)3)14-6-8-15(26-4)9-7-14/h5-11,17H,12H2,1-4H3,(H,23,25)/p+1/t17-/m0/s1