(2R)-2-(3-bromophenyl)-1-(2-morpholin-4-ium-4-ylethyl)-4-oxidanyl-3-thiophen-2-ylcarbonyl-2H-pyrrol-5-one

Systemtic Name: (2R)-2-(3-bromophenyl)-1-(2-morpholin-4-ium-4-ylethyl)-4-oxidanyl-3-thiophen-2-ylcarbonyl-2H-pyrrol-5-one Openeye Name: (2R)-2-(3-bromophenyl)-4-hydroxy-1-(2-morpholin-4-ium-4-ylethyl)-3-(thiophene-2-carbonyl)-2H-pyrrol-5-one CAS Name: (2R)-2-(3-bromophenyl)-4-hydroxy-1-[2-(4-morpholin-4-iumyl)ethyl]-3-[oxo(thiophen-2-yl)methyl]-2H-pyrrol-5-one IUPAC Name: (2R)-2-(3-bromophenyl)-4-hydroxy-1-(2-morpholin-4-ium-4-ylethyl)-3-(thiophene-2-carbonyl)-2H-pyrrol-5-one Traditional Name: (5R)-5-(3-bromophenyl)-3-hydroxy-1-(2-morpholin-4-ium-4-ylethyl)-4-(2-thenoyl)-3-pyrrolin-2-one Formula: C21H22BrN2O4S+ MolecularWeight: 478.37938

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCN2C(C(=C(C2=O)O)C(=O)C3=CC=CS3)C4=CC(=CC=C4)Br

Isomeric SMILES

C1COCC[NH+]1CCN2[C@@H](C(=C(C2=O)O)C(=O)C3=CC=CS3)C4=CC(=CC=C4)Br

InChI

InChI=1S/C21H21BrN2O4S/c22-15-4-1-3-14(13-15)18-17(19(25)16-5-2-12-29-16)20(26)21(27)24(18)7-6-23-8-10-28-11-9-23/h1-5,12-13,18,26H,6-11H2/p+1/t18-/m1/s1