1,2,4-oxathiazinan-4-yl 3-[(4-azanyl-5-chloranyl-2-methoxy-phenyl)carbonylamino]propanoate

Systemtic Name: 1,2,4-oxathiazinan-4-yl 3-[(4-azanyl-5-chloranyl-2-methoxy-phenyl)carbonylamino]propanoate Openeye Name: 1,2,4-oxathiazinan-4-yl 3-[(4-amino-5-chloro-2-methoxy-benzoyl)amino]propanoate CAS Name: 3-[[(4-amino-5-chloro-2-methoxyphenyl)-oxomethyl]amino]propanoic acid 1,2,4-oxathiazinan-4-yl ester IUPAC Name: 1,2,4-oxathiazinan-4-yl 3-[(4-amino-5-chloro-2-methoxybenzoyl)amino]propanoate Traditional Name: 3-[(4-amino-5-chloro-2-methoxy-benzoyl)amino]propionic acid 1,2,4-oxathiazinan-4-yl ester Formula: C14H18ClN3O5S MolecularWeight: 375.82782

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1C(=O)NCCC(=O)ON2CCOSC2)Cl)N

Isomeric SMILES

COC1=CC(=C(C=C1C(=O)NCCC(=O)ON2CCOSC2)Cl)N

InChI

InChI=1S/C14H18ClN3O5S/c1-21-12-7-11(16)10(15)6-9(12)14(20)17-3-2-13(19)23-18-4-5-22-24-8-18/h6-7H,2-5,8,16H2,1H3,(H,17,20)