5-chloranyl-2-(2-cyanoethanoylamino)-4-(4-nitrophenyl)thiophene-3-carboxylic acid

Systemtic Name: 5-chloranyl-2-(2-cyanoethanoylamino)-4-(4-nitrophenyl)thiophene-3-carboxylic acid Openeye Name: 5-chloro-2-[(2-cyanoacetyl)amino]-4-(4-nitrophenyl)thiophene-3-carboxylic acid CAS Name: 5-chloro-2-[(2-cyano-1-oxoethyl)amino]-4-(4-nitrophenyl)-3-thiophenecarboxylic acid IUPAC Name: 5-chloro-2-[(2-cyanoacetyl)amino]-4-(4-nitrophenyl)thiophene-3-carboxylic acid Traditional Name: 5-chloro-2-[(2-cyanoacetyl)amino]-4-(4-nitrophenyl)-3-thenoic acid Formula: C14H8ClN3O5S MolecularWeight: 365.74842

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=C(SC(=C2C(=O)O)NC(=O)CC#N)Cl)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C2=C(SC(=C2C(=O)O)NC(=O)CC#N)Cl)[N+](=O)[O-]

InChI

InChI=1S/C14H8ClN3O5S/c15-12-10(7-1-3-8(4-2-7)18(22)23)11(14(20)21)13(24-12)17-9(19)5-6-16/h1-4H,5H2,(H,17,19)(H,20,21)