2,3-dimethoxy-12-methyl-13-oxidanylidene-[1,3]benzodioxolo[5,6-c]phenanthridine-6-carboxylic acid

Systemtic Name: 2,3-dimethoxy-12-methyl-13-oxidanylidene-[1,3]benzodioxolo[5,6-c]phenanthridine-6-carboxylic acid Openeye Name: 2,3-dimethoxy-12-methyl-13-oxo-[1,3]benzodioxolo[5,6-c]phenanthridine-6-carboxylic acid CAS Name: 2,3-dimethoxy-12-methyl-13-oxo-[1,3]benzodioxolo[5,6-c]phenanthridine-6-carboxylic acid IUPAC Name: 2,3-dimethoxy-12-methyl-13-oxo-[1,3]benzodioxolo[5,6-c]phenanthridine-6-carboxylic acid Traditional Name: 13-keto-2,3-dimethoxy-12-methyl-[1,3]benzodioxolo[5,6-c]phenanthridine-6-carboxylic acid Formula: C22H17NO7 MolecularWeight: 407.37288

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C3C=C4C(=CC3=C(C=C2C5=CC(=C(C=C5C1=O)OC)OC)C(=O)O)OCO4

Isomeric SMILES

CN1C2=C3C=C4C(=CC3=C(C=C2C5=CC(=C(C=C5C1=O)OC)OC)C(=O)O)OCO4

InChI

InChI=1S/C22H17NO7/c1-23-20-12(10-5-16(27-2)17(28-3)8-14(10)21(23)24)4-15(22(25)26)11-6-18-19(7-13(11)20)30-9-29-18/h4-8H,9H2,1-3H3,(H,25,26)