propan-2-yl 3-[(4-chloranyl-3-methylsulfonyl-phenyl)carbonylamino]propanoate

Systemtic Name: propan-2-yl 3-[(4-chloranyl-3-methylsulfonyl-phenyl)carbonylamino]propanoate Openeye Name: isopropyl 3-[(4-chloro-3-methylsulfonyl-benzoyl)amino]propanoate CAS Name: 3-[[(4-chloro-3-methylsulfonylphenyl)-oxomethyl]amino]propanoic acid propan-2-yl ester IUPAC Name: propan-2-yl 3-[(4-chloro-3-methylsulfonylbenzoyl)amino]propanoate Traditional Name: 3-[(4-chloro-3-mesyl-benzoyl)amino]propionic acid isopropyl ester Formula: C14H18ClNO5S MolecularWeight: 347.81442

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)CCNC(=O)C1=CC(=C(C=C1)Cl)S(=O)(=O)C

Isomeric SMILES

CC(C)OC(=O)CCNC(=O)C1=CC(=C(C=C1)Cl)S(=O)(=O)C

InChI

InChI=1S/C14H18ClNO5S/c1-9(2)21-13(17)6-7-16-14(18)10-4-5-11(15)12(8-10)22(3,19)20/h4-5,8-9H,6-7H2,1-3H3,(H,16,18)