N-(4-butylphenyl)-2-(3-methyl-4-oxidanylidene-phthalazin-1-yl)ethanamide

Systemtic Name: N-(4-butylphenyl)-2-(3-methyl-4-oxidanylidene-phthalazin-1-yl)ethanamide Openeye Name: N-(4-butylphenyl)-2-(3-methyl-4-oxo-phthalazin-1-yl)acetamide CAS Name: N-(4-butylphenyl)-2-(3-methyl-4-oxo-1-phthalazinyl)acetamide IUPAC Name: N-(4-butylphenyl)-2-(3-methyl-4-oxophthalazin-1-yl)acetamide Traditional Name: N-(4-butylphenyl)-2-(4-keto-3-methyl-phthalazin-1-yl)acetamide Formula: C21H23N3O2 MolecularWeight: 349.42622

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=O)CC2=NN(C(=O)C3=CC=CC=C32)C

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=O)CC2=NN(C(=O)C3=CC=CC=C32)C

InChI

InChI=1S/C21H23N3O2/c1-3-4-7-15-10-12-16(13-11-15)22-20(25)14-19-17-8-5-6-9-18(17)21(26)24(2)23-19/h5-6,8-13H,3-4,7,14H2,1-2H3,(H,22,25)