N-(6-methoxy-1,3-benzothiazol-2-yl)-1-oxidanylidene-3,4-dihydroisochromene-3-carboxamide

Systemtic Name: N-(6-methoxy-1,3-benzothiazol-2-yl)-1-oxidanylidene-3,4-dihydroisochromene-3-carboxamide Openeye Name: N-(6-methoxy-1,3-benzothiazol-2-yl)-1-oxo-isochromane-3-carboxamide CAS Name: N-(6-methoxy-1,3-benzothiazol-2-yl)-1-oxo-3,4-dihydro-1H-2-benzopyran-3-carboxamide IUPAC Name: N-(6-methoxy-1,3-benzothiazol-2-yl)-1-oxo-3,4-dihydroisochromene-3-carboxamide Traditional Name: 1-keto-N-(6-methoxy-1,3-benzothiazol-2-yl)isochroman-3-carboxamide Formula: C18H14N2O4S MolecularWeight: 354.37976

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N=C(S2)NC(=O)C3CC4=CC=CC=C4C(=O)O3

Isomeric SMILES

COC1=CC2=C(C=C1)N=C(S2)NC(=O)C3CC4=CC=CC=C4C(=O)O3

InChI

InChI=1S/C18H14N2O4S/c1-23-11-6-7-13-15(9-11)25-18(19-13)20-16(21)14-8-10-4-2-3-5-12(10)17(22)24-14/h2-7,9,14H,8H2,1H3,(H,19,20,21)