6,7-dimethoxy-3-[[4-(3-nitrophenyl)-1,3-thiazol-2-yl]amino]-3H-2-benzofuran-1-one

Systemtic Name: 6,7-dimethoxy-3-[[4-(3-nitrophenyl)-1,3-thiazol-2-yl]amino]-3H-2-benzofuran-1-one Openeye Name: 6,7-dimethoxy-3-[[4-(3-nitrophenyl)thiazol-2-yl]amino]-3H-isobenzofuran-1-one CAS Name: 6,7-dimethoxy-3-[[4-(3-nitrophenyl)-2-thiazolyl]amino]-3H-isobenzofuran-1-one IUPAC Name: 6,7-dimethoxy-3-[[4-(3-nitrophenyl)-1,3-thiazol-2-yl]amino]-3H-2-benzofuran-1-one Traditional Name: 6,7-dimethoxy-3-[[4-(3-nitrophenyl)thiazol-2-yl]amino]phthalide Formula: C19H15N3O6S MolecularWeight: 413.4039

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H15N3O6S/c1-26-14-7-6-12-15(16(14)27-2)18(23)28-17(12)21-19-20-13(9-29-19)10-4-3-5-11(8-10)22(24)25/h3-9,17H,1-2H3,(H,20,21)