2-(4-chlorophenyl)-4-oxidanyl-1-(pyridin-1-ium-3-ylmethyl)-3-thiophen-2-ylcarbonyl-2H-pyrrol-5-one

Systemtic Name: 2-(4-chlorophenyl)-4-oxidanyl-1-(pyridin-1-ium-3-ylmethyl)-3-thiophen-2-ylcarbonyl-2H-pyrrol-5-one Openeye Name: 2-(4-chlorophenyl)-4-hydroxy-1-(pyridin-1-ium-3-ylmethyl)-3-(thiophene-2-carbonyl)-2H-pyrrol-5-one CAS Name: 2-(4-chlorophenyl)-4-hydroxy-3-[oxo(thiophen-2-yl)methyl]-1-(3-pyridin-1-iumylmethyl)-2H-pyrrol-5-one IUPAC Name: 2-(4-chlorophenyl)-4-hydroxy-1-(pyridin-1-ium-3-ylmethyl)-3-(thiophene-2-carbonyl)-2H-pyrrol-5-one Traditional Name: 5-(4-chlorophenyl)-3-hydroxy-1-(pyridin-1-ium-3-ylmethyl)-4-(2-thenoyl)-3-pyrrolin-2-one Formula: C21H16ClN2O3S+ MolecularWeight: 411.88134

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C[NH+]=C1)CN2C(C(=C(C2=O)O)C(=O)C3=CC=CS3)C4=CC=C(C=C4)Cl

Isomeric SMILES

C1=CC(=C[NH+]=C1)CN2C(C(=C(C2=O)O)C(=O)C3=CC=CS3)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C21H15ClN2O3S/c22-15-7-5-14(6-8-15)18-17(19(25)16-4-2-10-28-16)20(26)21(27)24(18)12-13-3-1-9-23-11-13/h1-11,18,26H,12H2/p+1