N-(2-methoxy-5-methyl-phenyl)-4-oxidanylidene-3-propyl-phthalazine-1-carboxamide

Systemtic Name: N-(2-methoxy-5-methyl-phenyl)-4-oxidanylidene-3-propyl-phthalazine-1-carboxamide Openeye Name: N-(2-methoxy-5-methyl-phenyl)-4-oxo-3-propyl-phthalazine-1-carboxamide CAS Name: N-(2-methoxy-5-methylphenyl)-4-oxo-3-propyl-1-phthalazinecarboxamide IUPAC Name: N-(2-methoxy-5-methylphenyl)-4-oxo-3-propylphthalazine-1-carboxamide Traditional Name: 4-keto-N-(2-methoxy-5-methyl-phenyl)-3-propyl-phthalazine-1-carboxamide Formula: C20H21N3O3 MolecularWeight: 351.39904

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=C(C=CC(=C3)C)OC

Isomeric SMILES

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=C(C=CC(=C3)C)OC

InChI

InChI=1S/C20H21N3O3/c1-4-11-23-20(25)15-8-6-5-7-14(15)18(22-23)19(24)21-16-12-13(2)9-10-17(16)26-3/h5-10,12H,4,11H2,1-3H3,(H,21,24)