2-(4-methylphenoxy)ethyl 4-oxidanylidene-3-pentyl-phthalazine-1-carboxylate

Systemtic Name: 2-(4-methylphenoxy)ethyl 4-oxidanylidene-3-pentyl-phthalazine-1-carboxylate Openeye Name: 2-(4-methylphenoxy)ethyl 4-oxo-3-pentyl-phthalazine-1-carboxylate CAS Name: 4-oxo-3-pentyl-1-phthalazinecarboxylic acid 2-(4-methylphenoxy)ethyl ester IUPAC Name: 2-(4-methylphenoxy)ethyl 4-oxo-3-pentylphthalazine-1-carboxylate Traditional Name: 3-amyl-4-keto-phthalazine-1-carboxylic acid 2-(4-methylphenoxy)ethyl ester Formula: C23H26N2O4 MolecularWeight: 394.46354

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)OCCOC3=CC=C(C=C3)C

Isomeric SMILES

CCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)OCCOC3=CC=C(C=C3)C

InChI

InChI=1S/C23H26N2O4/c1-3-4-7-14-25-22(26)20-9-6-5-8-19(20)21(24-25)23(27)29-16-15-28-18-12-10-17(2)11-13-18/h5-6,8-13H,3-4,7,14-16H2,1-2H3