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

Systemtic Name: methyl 2-[(3-ethyl-4-oxidanylidene-phthalazin-1-yl)carbonylamino]-4,5-dimethoxy-benzoate Openeye Name: methyl 2-[(3-ethyl-4-oxo-phthalazine-1-carbonyl)amino]-4,5-dimethoxy-benzoate CAS Name: 2-[[(3-ethyl-4-oxo-1-phthalazinyl)-oxomethyl]amino]-4,5-dimethoxybenzoic acid methyl ester IUPAC Name: methyl 2-[(3-ethyl-4-oxophthalazine-1-carbonyl)amino]-4,5-dimethoxybenzoate Traditional Name: 2-[(3-ethyl-4-keto-phthalazine-1-carbonyl)amino]-4,5-dimethoxy-benzoic acid methyl ester Formula: C21H21N3O6 MolecularWeight: 411.40794

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=CC(=C(C=C3C(=O)OC)OC)OC

Isomeric SMILES

CCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=CC(=C(C=C3C(=O)OC)OC)OC

InChI

InChI=1S/C21H21N3O6/c1-5-24-20(26)13-9-7-6-8-12(13)18(23-24)19(25)22-15-11-17(29-3)16(28-2)10-14(15)21(27)30-4/h6-11H,5H2,1-4H3,(H,22,25)