4-(3,4-dimethylphenyl)-N-(3-methylbutyl)phthalazin-1-amine

Systemtic Name: 4-(3,4-dimethylphenyl)-N-(3-methylbutyl)phthalazin-1-amine Openeye Name: 4-(3,4-dimethylphenyl)-N-isopentyl-phthalazin-1-amine CAS Name: 4-(3,4-dimethylphenyl)-N-(3-methylbutyl)-1-phthalazinamine IUPAC Name: 4-(3,4-dimethylphenyl)-N-(3-methylbutyl)phthalazin-1-amine Traditional Name: [4-(3,4-dimethylphenyl)phthalazin-1-yl]-isoamyl-amine Formula: C21H25N3 MolecularWeight: 319.4433

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=NN=C(C3=CC=CC=C32)NCCC(C)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NN=C(C3=CC=CC=C32)NCCC(C)C)C

InChI

InChI=1S/C21H25N3/c1-14(2)11-12-22-21-19-8-6-5-7-18(19)20(23-24-21)17-10-9-15(3)16(4)13-17/h5-10,13-14H,11-12H2,1-4H3,(H,22,24)