[(1S)-2-oxidanylidenecyclohexyl] 3-(3-oxidanylidene-1,4-benzothiazin-4-yl)propanoate

Systemtic Name: [(1S)-2-oxidanylidenecyclohexyl] 3-(3-oxidanylidene-1,4-benzothiazin-4-yl)propanoate Openeye Name: [(1S)-2-oxocyclohexyl] 3-(3-oxo-1,4-benzothiazin-4-yl)propanoate CAS Name: 3-(3-oxo-1,4-benzothiazin-4-yl)propanoic acid [(1S)-2-oxocyclohexyl] ester IUPAC Name: [(1S)-2-oxocyclohexyl] 3-(3-oxo-1,4-benzothiazin-4-yl)propanoate Traditional Name: 3-(3-keto-1,4-benzothiazin-4-yl)propionic acid [(1S)-2-ketocyclohexyl] ester Formula: C17H19NO4S MolecularWeight: 333.40206

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=O)C(C1)OC(=O)CCN2C(=O)CSC3=CC=CC=C32

Isomeric SMILES

C1CCC(=O)[C@H](C1)OC(=O)CCN2C(=O)CSC3=CC=CC=C32

InChI

InChI=1S/C17H19NO4S/c19-13-6-2-3-7-14(13)22-17(21)9-10-18-12-5-1-4-8-15(12)23-11-16(18)20/h1,4-5,8,14H,2-3,6-7,9-11H2/t14-/m0/s1