[(1R)-1-phenylethyl] 2-[(2S)-3-oxidanylidene-4H-1,4-benzothiazin-2-yl]ethanoate

Systemtic Name: [(1R)-1-phenylethyl] 2-[(2S)-3-oxidanylidene-4H-1,4-benzothiazin-2-yl]ethanoate Openeye Name: [(1R)-1-phenylethyl] 2-[(2S)-3-oxo-4H-1,4-benzothiazin-2-yl]acetate CAS Name: 2-[(2S)-3-oxo-4H-1,4-benzothiazin-2-yl]acetic acid [(1R)-1-phenylethyl] ester IUPAC Name: [(1R)-1-phenylethyl] 2-[(2S)-3-oxo-4H-1,4-benzothiazin-2-yl]acetate Traditional Name: 2-[(2S)-3-keto-4H-1,4-benzothiazin-2-yl]acetic acid [(1R)-1-phenylethyl] ester Formula: C18H17NO3S MolecularWeight: 327.39748

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)OC(=O)CC2C(=O)NC3=CC=CC=C3S2

Isomeric SMILES

C[C@H](C1=CC=CC=C1)OC(=O)C[C@H]2C(=O)NC3=CC=CC=C3S2

InChI

InChI=1S/C18H17NO3S/c1-12(13-7-3-2-4-8-13)22-17(20)11-16-18(21)19-14-9-5-6-10-15(14)23-16/h2-10,12,16H,11H2,1H3,(H,19,21)/t12-,16+/m1/s1