ethyl 3-[4-chloranyl-2-(ethoxycarbonylamino)phenyl]-2-methylsulfonyl-3-oxidanylidene-propanoate

Systemtic Name: ethyl 3-[4-chloranyl-2-(ethoxycarbonylamino)phenyl]-2-methylsulfonyl-3-oxidanylidene-propanoate Openeye Name: ethyl 3-[4-chloro-2-(ethoxycarbonylamino)phenyl]-2-methylsulfonyl-3-oxo-propanoate CAS Name: 3-[4-chloro-2-(ethoxycarbonylamino)phenyl]-2-methylsulfonyl-3-oxopropanoic acid ethyl ester IUPAC Name: ethyl 3-[4-chloro-2-(ethoxycarbonylamino)phenyl]-2-methylsulfonyl-3-oxopropanoate Traditional Name: 3-[2-(carbethoxyamino)-4-chloro-phenyl]-3-keto-2-mesyl-propionic acid ethyl ester Formula: C15H18ClNO7S MolecularWeight: 391.82392

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(=O)C1=C(C=C(C=C1)Cl)NC(=O)OCC)S(=O)(=O)C

Isomeric SMILES

CCOC(=O)C(C(=O)C1=C(C=C(C=C1)Cl)NC(=O)OCC)S(=O)(=O)C

InChI

InChI=1S/C15H18ClNO7S/c1-4-23-14(19)13(25(3,21)22)12(18)10-7-6-9(16)8-11(10)17-15(20)24-5-2/h6-8,13H,4-5H2,1-3H3,(H,17,20)