methyl 2-[2-(4-methoxyphenyl)-1,1-bis(oxidanylidene)-3H-1,2-benzothiazol-3-yl]ethanoate

Systemtic Name: methyl 2-[2-(4-methoxyphenyl)-1,1-bis(oxidanylidene)-3H-1,2-benzothiazol-3-yl]ethanoate Openeye Name: methyl 2-[2-(4-methoxyphenyl)-1,1-dioxo-3H-1,2-benzothiazol-3-yl]acetate CAS Name: 2-[2-(4-methoxyphenyl)-1,1-dioxo-3H-1,2-benzothiazol-3-yl]acetic acid methyl ester IUPAC Name: methyl 2-[2-(4-methoxyphenyl)-1,1-dioxo-3H-1,2-benzothiazol-3-yl]acetate Traditional Name: 2-[1,1-diketo-2-(4-methoxyphenyl)-3H-1,2-benzothiazol-3-yl]acetic acid methyl ester Formula: C17H17NO5S MolecularWeight: 347.38558

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2C(C3=CC=CC=C3S2(=O)=O)CC(=O)OC

Isomeric SMILES

COC1=CC=C(C=C1)N2C(C3=CC=CC=C3S2(=O)=O)CC(=O)OC

InChI

InChI=1S/C17H17NO5S/c1-22-13-9-7-12(8-10-13)18-15(11-17(19)23-2)14-5-3-4-6-16(14)24(18,20)21/h3-10,15H,11H2,1-2H3