2-[1,4-bis(oxidanylidene)-3H-phthalazin-2-yl]-N-(4-butylphenyl)ethanamide

Systemtic Name: 2-[1,4-bis(oxidanylidene)-3H-phthalazin-2-yl]-N-(4-butylphenyl)ethanamide Openeye Name: N-(4-butylphenyl)-2-(1,4-dioxo-3H-phthalazin-2-yl)acetamide CAS Name: N-(4-butylphenyl)-2-(1,4-dioxo-3H-phthalazin-2-yl)acetamide IUPAC Name: N-(4-butylphenyl)-2-(1,4-dioxo-3H-phthalazin-2-yl)acetamide Traditional Name: N-(4-butylphenyl)-2-(1,4-diketo-3H-phthalazin-2-yl)acetamide Formula: C20H21N3O3 MolecularWeight: 351.39904

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=O)CN2C(=O)C3=CC=CC=C3C(=O)N2

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=O)CN2C(=O)C3=CC=CC=C3C(=O)N2

InChI

InChI=1S/C20H21N3O3/c1-2-3-6-14-9-11-15(12-10-14)21-18(24)13-23-20(26)17-8-5-4-7-16(17)19(25)22-23/h4-5,7-12H,2-3,6,13H2,1H3,(H,21,24)(H,22,25)