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

Systemtic Name: 2-(3-methylphenoxy)ethyl 4-oxidanylidene-3-propyl-phthalazine-1-carboxylate Openeye Name: 2-(3-methylphenoxy)ethyl 4-oxo-3-propyl-phthalazine-1-carboxylate CAS Name: 4-oxo-3-propyl-1-phthalazinecarboxylic acid 2-(3-methylphenoxy)ethyl ester IUPAC Name: 2-(3-methylphenoxy)ethyl 4-oxo-3-propylphthalazine-1-carboxylate Traditional Name: 4-keto-3-propyl-phthalazine-1-carboxylic acid 2-(3-methylphenoxy)ethyl ester Formula: C21H22N2O4 MolecularWeight: 366.41038

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)OCCOC3=CC=CC(=C3)C

Isomeric SMILES

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)OCCOC3=CC=CC(=C3)C

InChI

InChI=1S/C21H22N2O4/c1-3-11-23-20(24)18-10-5-4-9-17(18)19(22-23)21(25)27-13-12-26-16-8-6-7-15(2)14-16/h4-10,14H,3,11-13H2,1-2H3