(2-oxidanylidenechromen-7-yl) 4-oxidanylidene-3-pentyl-phthalazine-1-carboxylate

Systemtic Name: (2-oxidanylidenechromen-7-yl) 4-oxidanylidene-3-pentyl-phthalazine-1-carboxylate Openeye Name: (2-oxochromen-7-yl) 4-oxo-3-pentyl-phthalazine-1-carboxylate CAS Name: 4-oxo-3-pentyl-1-phthalazinecarboxylic acid (2-oxo-1-benzopyran-7-yl) ester IUPAC Name: (2-oxochromen-7-yl) 4-oxo-3-pentylphthalazine-1-carboxylate Traditional Name: 3-amyl-4-keto-phthalazine-1-carboxylic acid (2-ketochromen-7-yl) ester Formula: C23H20N2O5 MolecularWeight: 404.4153

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)OC3=CC4=C(C=C3)C=CC(=O)O4

Isomeric SMILES

CCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)OC3=CC4=C(C=C3)C=CC(=O)O4

InChI

InChI=1S/C23H20N2O5/c1-2-3-6-13-25-22(27)18-8-5-4-7-17(18)21(24-25)23(28)29-16-11-9-15-10-12-20(26)30-19(15)14-16/h4-5,7-12,14H,2-3,6,13H2,1H3