(7-oxidanyl-2-oxidanylidene-chromen-4-yl)methyl 2-(1,3-benzothiazol-2-ylmethoxy)ethanoate

Systemtic Name: (7-oxidanyl-2-oxidanylidene-chromen-4-yl)methyl 2-(1,3-benzothiazol-2-ylmethoxy)ethanoate Openeye Name: (7-hydroxy-2-oxo-chromen-4-yl)methyl 2-(1,3-benzothiazol-2-ylmethoxy)acetate CAS Name: 2-(1,3-benzothiazol-2-ylmethoxy)acetic acid (7-hydroxy-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (7-hydroxy-2-oxochromen-4-yl)methyl 2-(1,3-benzothiazol-2-ylmethoxy)acetate Traditional Name: 2-(1,3-benzothiazol-2-ylmethoxy)acetic acid (7-hydroxy-2-keto-chromen-4-yl)methyl ester Formula: C20H15NO6S MolecularWeight: 397.4012

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)COCC(=O)OCC3=CC(=O)OC4=C3C=CC(=C4)O

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)COCC(=O)OCC3=CC(=O)OC4=C3C=CC(=C4)O

InChI

InChI=1S/C20H15NO6S/c22-13-5-6-14-12(7-19(23)27-16(14)8-13)9-26-20(24)11-25-10-18-21-15-3-1-2-4-17(15)28-18/h1-8,22H,9-11H2