(4-chloranyl-2-methyl-phenyl) 3-(3-oxidanylidene-1,4-benzothiazin-4-yl)propanoate

Systemtic Name: (4-chloranyl-2-methyl-phenyl) 3-(3-oxidanylidene-1,4-benzothiazin-4-yl)propanoate Openeye Name: (4-chloro-2-methyl-phenyl) 3-(3-oxo-1,4-benzothiazin-4-yl)propanoate CAS Name: 3-(3-oxo-1,4-benzothiazin-4-yl)propanoic acid (4-chloro-2-methylphenyl) ester IUPAC Name: (4-chloro-2-methylphenyl) 3-(3-oxo-1,4-benzothiazin-4-yl)propanoate Traditional Name: 3-(3-keto-1,4-benzothiazin-4-yl)propionic acid (4-chloro-2-methyl-phenyl) ester Formula: C18H16ClNO3S MolecularWeight: 361.84254

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Cl)OC(=O)CCN2C(=O)CSC3=CC=CC=C32

Isomeric SMILES

CC1=C(C=CC(=C1)Cl)OC(=O)CCN2C(=O)CSC3=CC=CC=C32

InChI

InChI=1S/C18H16ClNO3S/c1-12-10-13(19)6-7-15(12)23-18(22)8-9-20-14-4-2-3-5-16(14)24-11-17(20)21/h2-7,10H,8-9,11H2,1H3