2-[1,1,3-tris(oxidanylidene)-1,2-benzothiazol-2-yl]ethyl 3-methoxy-4-methyl-benzoate

Systemtic Name: 2-[1,1,3-tris(oxidanylidene)-1,2-benzothiazol-2-yl]ethyl 3-methoxy-4-methyl-benzoate Openeye Name: 2-(1,1,3-trioxo-1,2-benzothiazol-2-yl)ethyl 3-methoxy-4-methyl-benzoate CAS Name: 3-methoxy-4-methylbenzoic acid 2-(1,1,3-trioxo-1,2-benzothiazol-2-yl)ethyl ester IUPAC Name: 2-(1,1,3-trioxo-1,2-benzothiazol-2-yl)ethyl 3-methoxy-4-methylbenzoate Traditional Name: 3-methoxy-4-methyl-benzoic acid 2-(1,1,3-triketo-1,2-benzothiazol-2-yl)ethyl ester Formula: C18H17NO6S MolecularWeight: 375.39568

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OCCN2C(=O)C3=CC=CC=C3S2(=O)=O)OC

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OCCN2C(=O)C3=CC=CC=C3S2(=O)=O)OC

InChI

InChI=1S/C18H17NO6S/c1-12-7-8-13(11-15(12)24-2)18(21)25-10-9-19-17(20)14-5-3-4-6-16(14)26(19,22)23/h3-8,11H,9-10H2,1-2H3