ethyl 2-[(4-oxidanylidene-3-pentyl-phthalazin-1-yl)carbonylamino]benzoate

Systemtic Name: ethyl 2-[(4-oxidanylidene-3-pentyl-phthalazin-1-yl)carbonylamino]benzoate Openeye Name: ethyl 2-[(4-oxo-3-pentyl-phthalazine-1-carbonyl)amino]benzoate CAS Name: 2-[[oxo-(4-oxo-3-pentyl-1-phthalazinyl)methyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 2-[(4-oxo-3-pentylphthalazine-1-carbonyl)amino]benzoate Traditional Name: 2-[(3-amyl-4-keto-phthalazine-1-carbonyl)amino]benzoic acid ethyl ester Formula: C23H25N3O4 MolecularWeight: 407.4623

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=CC=CC=C3C(=O)OCC

Isomeric SMILES

CCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=CC=CC=C3C(=O)OCC

InChI

InChI=1S/C23H25N3O4/c1-3-5-10-15-26-22(28)17-12-7-6-11-16(17)20(25-26)21(27)24-19-14-9-8-13-18(19)23(29)30-4-2/h6-9,11-14H,3-5,10,15H2,1-2H3,(H,24,27)