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

Systemtic Name: (2-oxidanylidenechromen-7-yl) 3-butyl-4-oxidanylidene-phthalazine-1-carboxylate Openeye Name: (2-oxochromen-7-yl) 3-butyl-4-oxo-phthalazine-1-carboxylate CAS Name: 3-butyl-4-oxo-1-phthalazinecarboxylic acid (2-oxo-1-benzopyran-7-yl) ester IUPAC Name: (2-oxochromen-7-yl) 3-butyl-4-oxophthalazine-1-carboxylate Traditional Name: 3-butyl-4-keto-phthalazine-1-carboxylic acid (2-ketochromen-7-yl) ester Formula: C22H18N2O5 MolecularWeight: 390.38872

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)OC3=CC4=C(C=C3)C=CC(=O)O4

Isomeric SMILES

CCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)OC3=CC4=C(C=C3)C=CC(=O)O4

InChI

InChI=1S/C22H18N2O5/c1-2-3-12-24-21(26)17-7-5-4-6-16(17)20(23-24)22(27)28-15-10-8-14-9-11-19(25)29-18(14)13-15/h4-11,13H,2-3,12H2,1H3