(2-methylphenyl)methyl 2-[(2S)-6-chloranyl-3-oxidanylidene-4H-1,4-benzothiazin-2-yl]ethanoate

Systemtic Name: (2-methylphenyl)methyl 2-[(2S)-6-chloranyl-3-oxidanylidene-4H-1,4-benzothiazin-2-yl]ethanoate Openeye Name: o-tolylmethyl 2-[(2S)-6-chloro-3-oxo-4H-1,4-benzothiazin-2-yl]acetate CAS Name: 2-[(2S)-6-chloro-3-oxo-4H-1,4-benzothiazin-2-yl]acetic acid (2-methylphenyl)methyl ester IUPAC Name: (2-methylphenyl)methyl 2-[(2S)-6-chloro-3-oxo-4H-1,4-benzothiazin-2-yl]acetate Traditional Name: 2-[(2S)-6-chloro-3-keto-4H-1,4-benzothiazin-2-yl]acetic acid (2-methylbenzyl) ester Formula: C18H16ClNO3S MolecularWeight: 361.84254

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1COC(=O)CC2C(=O)NC3=C(S2)C=CC(=C3)Cl

Isomeric SMILES

CC1=CC=CC=C1COC(=O)C[C@H]2C(=O)NC3=C(S2)C=CC(=C3)Cl

InChI

InChI=1S/C18H16ClNO3S/c1-11-4-2-3-5-12(11)10-23-17(21)9-16-18(22)20-14-8-13(19)6-7-15(14)24-16/h2-8,16H,9-10H2,1H3,(H,20,22)/t16-/m0/s1