3-(3,4-dimethoxyphenyl)-4-oxidanylidene-phthalazine-1-carboxylic acid

Systemtic Name: 3-(3,4-dimethoxyphenyl)-4-oxidanylidene-phthalazine-1-carboxylic acid Openeye Name: 3-(3,4-dimethoxyphenyl)-4-oxo-phthalazine-1-carboxylic acid CAS Name: 3-(3,4-dimethoxyphenyl)-4-oxo-1-phthalazinecarboxylic acid IUPAC Name: 3-(3,4-dimethoxyphenyl)-4-oxophthalazine-1-carboxylic acid Traditional Name: 3-(3,4-dimethoxyphenyl)-4-keto-phthalazine-1-carboxylic acid Formula: C17H14N2O5 MolecularWeight: 326.30346

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)N2C(=O)C3=CC=CC=C3C(=N2)C(=O)O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)N2C(=O)C3=CC=CC=C3C(=N2)C(=O)O)OC

InChI

InChI=1S/C17H14N2O5/c1-23-13-8-7-10(9-14(13)24-2)19-16(20)12-6-4-3-5-11(12)15(18-19)17(21)22/h3-9H,1-2H3,(H,21,22)