(3-phenoxyphenyl)methyl 2-(4-chloranyl-2-oxidanylidene-1,3-benzothiazol-3-yl)ethanoate

Systemtic Name: (3-phenoxyphenyl)methyl 2-(4-chloranyl-2-oxidanylidene-1,3-benzothiazol-3-yl)ethanoate Openeye Name: (3-phenoxyphenyl)methyl 2-(4-chloro-2-oxo-1,3-benzothiazol-3-yl)acetate CAS Name: 2-(4-chloro-2-oxo-1,3-benzothiazol-3-yl)acetic acid (3-phenoxyphenyl)methyl ester IUPAC Name: (3-phenoxyphenyl)methyl 2-(4-chloro-2-oxo-1,3-benzothiazol-3-yl)acetate Traditional Name: 2-(4-chloro-2-keto-1,3-benzothiazol-3-yl)acetic acid (3-phenoxybenzyl) ester Formula: C22H16ClNO4S MolecularWeight: 425.88474

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=CC=CC(=C2)COC(=O)CN3C4=C(C=CC=C4Cl)SC3=O

Isomeric SMILES

C1=CC=C(C=C1)OC2=CC=CC(=C2)COC(=O)CN3C4=C(C=CC=C4Cl)SC3=O

InChI

InChI=1S/C22H16ClNO4S/c23-18-10-5-11-19-21(18)24(22(26)29-19)13-20(25)27-14-15-6-4-9-17(12-15)28-16-7-2-1-3-8-16/h1-12H,13-14H2