(propan-2-ylideneamino) 3-chloranyl-4-methylsulfonyl-thiophene-2-carboxylate

Systemtic Name: (propan-2-ylideneamino) 3-chloranyl-4-methylsulfonyl-thiophene-2-carboxylate Openeye Name: (isopropylideneamino) 3-chloro-4-methylsulfonyl-thiophene-2-carboxylate CAS Name: 3-chloro-4-methylsulfonyl-2-thiophenecarboxylic acid (propan-2-ylideneamino) ester IUPAC Name: (propan-2-ylideneamino) 3-chloro-4-methylsulfonylthiophene-2-carboxylate Traditional Name: 3-chloro-4-mesyl-thiophene-2-carboxylic acid (isopropylideneamino) ester Formula: C9H10ClNO4S2 MolecularWeight: 295.763

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=NOC(=O)C1=C(C(=CS1)S(=O)(=O)C)Cl)C

Isomeric SMILES

CC(=NOC(=O)C1=C(C(=CS1)S(=O)(=O)C)Cl)C

InChI

InChI=1S/C9H10ClNO4S2/c1-5(2)11-15-9(12)8-7(10)6(4-16-8)17(3,13)14/h4H,1-3H3