(4-propanoylphenyl) 3-hexyl-4-oxidanylidene-phthalazine-1-carboxylate

Systemtic Name: (4-propanoylphenyl) 3-hexyl-4-oxidanylidene-phthalazine-1-carboxylate Openeye Name: (4-propanoylphenyl) 3-hexyl-4-oxo-phthalazine-1-carboxylate CAS Name: 3-hexyl-4-oxo-1-phthalazinecarboxylic acid [4-(1-oxopropyl)phenyl] ester IUPAC Name: (4-propanoylphenyl) 3-hexyl-4-oxophthalazine-1-carboxylate Traditional Name: 3-hexyl-4-keto-phthalazine-1-carboxylic acid (4-propionylphenyl) ester Formula: C24H26N2O4 MolecularWeight: 406.47424

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)OC3=CC=C(C=C3)C(=O)CC

Isomeric SMILES

CCCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)OC3=CC=C(C=C3)C(=O)CC

InChI

InChI=1S/C24H26N2O4/c1-3-5-6-9-16-26-23(28)20-11-8-7-10-19(20)22(25-26)24(29)30-18-14-12-17(13-15-18)21(27)4-2/h7-8,10-15H,3-6,9,16H2,1-2H3