3-butyl-N-(3-ethanoylphenyl)-4-oxidanylidene-phthalazine-1-carboxamide

Systemtic Name: 3-butyl-N-(3-ethanoylphenyl)-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: N-(3-acetylphenyl)-3-butyl-4-oxo-phthalazine-1-carboxamide CAS Name: N-(3-acetylphenyl)-3-butyl-4-oxo-1-phthalazinecarboxamide IUPAC Name: N-(3-acetylphenyl)-3-butyl-4-oxophthalazine-1-carboxamide Traditional Name: N-(3-acetylphenyl)-3-butyl-4-keto-phthalazine-1-carboxamide Formula: C21H21N3O3 MolecularWeight: 363.40974

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=CC=CC(=C3)C(=O)C

Isomeric SMILES

CCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=CC=CC(=C3)C(=O)C

InChI

InChI=1S/C21H21N3O3/c1-3-4-12-24-21(27)18-11-6-5-10-17(18)19(23-24)20(26)22-16-9-7-8-15(13-16)14(2)25/h5-11,13H,3-4,12H2,1-2H3,(H,22,26)