(5-ethanoyl-2-ethoxy-phenyl)methyl 3-butyl-4-oxidanylidene-phthalazine-1-carboxylate

Systemtic Name: (5-ethanoyl-2-ethoxy-phenyl)methyl 3-butyl-4-oxidanylidene-phthalazine-1-carboxylate Openeye Name: (5-acetyl-2-ethoxy-phenyl)methyl 3-butyl-4-oxo-phthalazine-1-carboxylate CAS Name: 3-butyl-4-oxo-1-phthalazinecarboxylic acid (5-acetyl-2-ethoxyphenyl)methyl ester IUPAC Name: (5-acetyl-2-ethoxyphenyl)methyl 3-butyl-4-oxophthalazine-1-carboxylate Traditional Name: 3-butyl-4-keto-phthalazine-1-carboxylic acid (5-acetyl-2-ethoxy-benzyl) ester Formula: C24H26N2O5 MolecularWeight: 422.47364

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)OCC3=C(C=CC(=C3)C(=O)C)OCC

Isomeric SMILES

CCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)OCC3=C(C=CC(=C3)C(=O)C)OCC

InChI

InChI=1S/C24H26N2O5/c1-4-6-13-26-23(28)20-10-8-7-9-19(20)22(25-26)24(29)31-15-18-14-17(16(3)27)11-12-21(18)30-5-2/h7-12,14H,4-6,13,15H2,1-3H3