methyl 2-[1,1-bis(oxidanylidene)-2-(phenylmethyl)-3H-1,2-benzothiazol-3-yl]ethanoate

Systemtic Name: methyl 2-[1,1-bis(oxidanylidene)-2-(phenylmethyl)-3H-1,2-benzothiazol-3-yl]ethanoate Openeye Name: methyl 2-(2-benzyl-1,1-dioxo-3H-1,2-benzothiazol-3-yl)acetate CAS Name: 2-[1,1-dioxo-2-(phenylmethyl)-3H-1,2-benzothiazol-3-yl]acetic acid methyl ester IUPAC Name: methyl 2-(2-benzyl-1,1-dioxo-3H-1,2-benzothiazol-3-yl)acetate Traditional Name: 2-(2-benzyl-1,1-diketo-3H-1,2-benzothiazol-3-yl)acetic acid methyl ester Formula: C17H17NO4S MolecularWeight: 331.38618

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC1C2=CC=CC=C2S(=O)(=O)N1CC3=CC=CC=C3

Isomeric SMILES

COC(=O)CC1C2=CC=CC=C2S(=O)(=O)N1CC3=CC=CC=C3

InChI

InChI=1S/C17H17NO4S/c1-22-17(19)11-15-14-9-5-6-10-16(14)23(20,21)18(15)12-13-7-3-2-4-8-13/h2-10,15H,11-12H2,1H3