(2R)-2-(4-chlorophenyl)-1-[2-(dimethylazaniumyl)ethyl]-5-oxidanylidene-3-thiophen-2-ylcarbonyl-2H-pyrrol-4-olate

Systemtic Name: (2R)-2-(4-chlorophenyl)-1-[2-(dimethylazaniumyl)ethyl]-5-oxidanylidene-3-thiophen-2-ylcarbonyl-2H-pyrrol-4-olate Openeye Name: (2R)-2-(4-chlorophenyl)-1-[2-(dimethylammonio)ethyl]-5-oxo-3-(thiophene-2-carbonyl)-2H-pyrrol-4-olate CAS Name: (2R)-2-(4-chlorophenyl)-1-[2-(dimethylammonio)ethyl]-5-oxo-3-[oxo(thiophen-2-yl)methyl]-2H-pyrrol-4-olate IUPAC Name: (2R)-2-(4-chlorophenyl)-1-[2-(dimethylazaniumyl)ethyl]-5-oxo-3-(thiophene-2-carbonyl)-2H-pyrrol-4-olate Traditional Name: (5R)-5-(4-chlorophenyl)-1-[2-(dimethylammonio)ethyl]-2-keto-4-(2-thenoyl)-3-pyrrolin-3-olate Formula: C19H19ClN2O3S MolecularWeight: 390.88376

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCN1C(C(=C(C1=O)[O-])C(=O)C2=CC=CS2)C3=CC=C(C=C3)Cl

Isomeric SMILES

C[NH+](C)CCN1[C@@H](C(=C(C1=O)[O-])C(=O)C2=CC=CS2)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C19H19ClN2O3S/c1-21(2)9-10-22-16(12-5-7-13(20)8-6-12)15(18(24)19(22)25)17(23)14-4-3-11-26-14/h3-8,11,16,24H,9-10H2,1-2H3/t16-/m1/s1