3-butyl-N-(2-ethanoylphenyl)-4-oxidanylidene-phthalazine-1-carboxamide

Systemtic Name: 3-butyl-N-(2-ethanoylphenyl)-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: N-(2-acetylphenyl)-3-butyl-4-oxo-phthalazine-1-carboxamide CAS Name: N-(2-acetylphenyl)-3-butyl-4-oxo-1-phthalazinecarboxamide IUPAC Name: N-(2-acetylphenyl)-3-butyl-4-oxophthalazine-1-carboxamide Traditional Name: N-(2-acetylphenyl)-3-butyl-4-keto-phthalazine-1-carboxamide Formula: C21H21N3O3 MolecularWeight: 363.40974

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=CC=CC=C3C(=O)C

Isomeric SMILES

CCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=CC=CC=C3C(=O)C

InChI

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