(2S)-1-[2-(2-hydroxyethyloxy)ethyl]-2-(2-nitrophenyl)-5-oxidanylidene-3-thiophen-2-ylcarbonyl-2H-pyrrol-4-olate

Systemtic Name: (2S)-1-[2-(2-hydroxyethyloxy)ethyl]-2-(2-nitrophenyl)-5-oxidanylidene-3-thiophen-2-ylcarbonyl-2H-pyrrol-4-olate Openeye Name: (2S)-1-[2-(2-hydroxyethoxy)ethyl]-2-(2-nitrophenyl)-5-oxo-3-(thiophene-2-carbonyl)-2H-pyrrol-4-olate CAS Name: (2S)-1-[2-(2-hydroxyethoxy)ethyl]-2-(2-nitrophenyl)-5-oxo-3-[oxo(thiophen-2-yl)methyl]-2H-pyrrol-4-olate IUPAC Name: (2S)-1-[2-(2-hydroxyethoxy)ethyl]-2-(2-nitrophenyl)-5-oxo-3-(thiophene-2-carbonyl)-2H-pyrrol-4-olate Traditional Name: (5S)-1-[2-(2-hydroxyethoxy)ethyl]-2-keto-5-(2-nitrophenyl)-4-(2-thenoyl)-3-pyrrolin-3-olate Formula: C19H17N2O7S- MolecularWeight: 417.41248

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C2C(=C(C(=O)N2CCOCCO)[O-])C(=O)C3=CC=CS3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C(=C1)[C@H]2C(=C(C(=O)N2CCOCCO)[O-])C(=O)C3=CC=CS3)[N+](=O)[O-]

InChI

InChI=1S/C19H18N2O7S/c22-8-10-28-9-7-20-16(12-4-1-2-5-13(12)21(26)27)15(18(24)19(20)25)17(23)14-6-3-11-29-14/h1-6,11,16,22,24H,7-10H2/p-1/t16-/m0/s1