(1,2-dimethoxy-13-oxidanylidene-12H-[1,3]benzodioxolo[5,6-c]phenanthridin-6-yl) benzoate

Systemtic Name: (1,2-dimethoxy-13-oxidanylidene-12H-[1,3]benzodioxolo[5,6-c]phenanthridin-6-yl) benzoate Openeye Name: (1,2-dimethoxy-13-oxo-12H-[1,3]benzodioxolo[5,6-c]phenanthridin-6-yl) benzoate CAS Name: benzoic acid (1,2-dimethoxy-13-oxo-12H-[1,3]benzodioxolo[5,6-c]phenanthridin-6-yl) ester IUPAC Name: (1,2-dimethoxy-13-oxo-12H-[1,3]benzodioxolo[5,6-c]phenanthridin-6-yl) benzoate Traditional Name: benzoic acid (13-keto-1,2-dimethoxy-12H-[1,3]benzodioxolo[5,6-c]phenanthridin-6-yl) ester Formula: C27H19NO7 MolecularWeight: 469.44226

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C2=C(C=C1)C3=C(C4=CC5=C(C=C4C(=C3)OC(=O)C6=CC=CC=C6)OCO5)NC2=O)OC

Isomeric SMILES

COC1=C(C2=C(C=C1)C3=C(C4=CC5=C(C=C4C(=C3)OC(=O)C6=CC=CC=C6)OCO5)NC2=O)OC

InChI

InChI=1S/C27H19NO7/c1-31-19-9-8-15-17-11-20(35-27(30)14-6-4-3-5-7-14)16-10-21-22(34-13-33-21)12-18(16)24(17)28-26(29)23(15)25(19)32-2/h3-12H,13H2,1-2H3,(H,28,29)