(5-methyl-2-phenyl-1,3-oxazol-4-yl)methyl 4-oxidanylidene-3-propyl-phthalazine-1-carboxylate

Systemtic Name: (5-methyl-2-phenyl-1,3-oxazol-4-yl)methyl 4-oxidanylidene-3-propyl-phthalazine-1-carboxylate Openeye Name: (5-methyl-2-phenyl-oxazol-4-yl)methyl 4-oxo-3-propyl-phthalazine-1-carboxylate CAS Name: 4-oxo-3-propyl-1-phthalazinecarboxylic acid (5-methyl-2-phenyl-4-oxazolyl)methyl ester IUPAC Name: (5-methyl-2-phenyl-1,3-oxazol-4-yl)methyl 4-oxo-3-propylphthalazine-1-carboxylate Traditional Name: 4-keto-3-propyl-phthalazine-1-carboxylic acid (5-methyl-2-phenyl-oxazol-4-yl)methyl ester Formula: C23H21N3O4 MolecularWeight: 403.43054

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)OCC3=C(OC(=N3)C4=CC=CC=C4)C

Isomeric SMILES

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)OCC3=C(OC(=N3)C4=CC=CC=C4)C

InChI

InChI=1S/C23H21N3O4/c1-3-13-26-22(27)18-12-8-7-11-17(18)20(25-26)23(28)29-14-19-15(2)30-21(24-19)16-9-5-4-6-10-16/h4-12H,3,13-14H2,1-2H3