methyl 4,5-dimethoxy-2-[(4-oxidanylidene-3-propyl-phthalazin-1-yl)carbonylamino]benzoate

Systemtic Name: methyl 4,5-dimethoxy-2-[(4-oxidanylidene-3-propyl-phthalazin-1-yl)carbonylamino]benzoate Openeye Name: methyl 4,5-dimethoxy-2-[(4-oxo-3-propyl-phthalazine-1-carbonyl)amino]benzoate CAS Name: 4,5-dimethoxy-2-[[oxo-(4-oxo-3-propyl-1-phthalazinyl)methyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4,5-dimethoxy-2-[(4-oxo-3-propylphthalazine-1-carbonyl)amino]benzoate Traditional Name: 2-[(4-keto-3-propyl-phthalazine-1-carbonyl)amino]-4,5-dimethoxy-benzoic acid methyl ester Formula: C22H23N3O6 MolecularWeight: 425.43452

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=CC(=C(C=C3C(=O)OC)OC)OC

Isomeric SMILES

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=CC(=C(C=C3C(=O)OC)OC)OC

InChI

InChI=1S/C22H23N3O6/c1-5-10-25-21(27)14-9-7-6-8-13(14)19(24-25)20(26)23-16-12-18(30-3)17(29-2)11-15(16)22(28)31-4/h6-9,11-12H,5,10H2,1-4H3,(H,23,26)