3-[2-[(4,5-dimethoxy-3-oxidanylidene-1H-2-benzofuran-1-yl)amino]-1,3-thiazol-4-yl]-6-nitro-chromen-2-one

Systemtic Name: 3-[2-[(4,5-dimethoxy-3-oxidanylidene-1H-2-benzofuran-1-yl)amino]-1,3-thiazol-4-yl]-6-nitro-chromen-2-one Openeye Name: 3-[2-[(4,5-dimethoxy-3-oxo-1H-isobenzofuran-1-yl)amino]thiazol-4-yl]-6-nitro-chromen-2-one CAS Name: 3-[2-[(4,5-dimethoxy-3-oxo-1H-isobenzofuran-1-yl)amino]-4-thiazolyl]-6-nitro-1-benzopyran-2-one IUPAC Name: 3-[2-[(4,5-dimethoxy-3-oxo-1H-2-benzofuran-1-yl)amino]-1,3-thiazol-4-yl]-6-nitrochromen-2-one Traditional Name: 3-[2-[(3-keto-4,5-dimethoxy-phthalan-1-yl)amino]thiazol-4-yl]-6-nitro-coumarin Formula: C22H15N3O8S MolecularWeight: 481.4348

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C2=C(C=C1)C(OC2=O)NC3=NC(=CS3)C4=CC5=C(C=CC(=C5)[N+](=O)[O-])OC4=O)OC

Isomeric SMILES

COC1=C(C2=C(C=C1)C(OC2=O)NC3=NC(=CS3)C4=CC5=C(C=CC(=C5)[N+](=O)[O-])OC4=O)OC

InChI

InChI=1S/C22H15N3O8S/c1-30-16-6-4-12-17(18(16)31-2)21(27)33-19(12)24-22-23-14(9-34-22)13-8-10-7-11(25(28)29)3-5-15(10)32-20(13)26/h3-9,19H,1-2H3,(H,23,24)