2-[4-(2-azanylethylamino)phthalazin-1-yl]ethanenitrile

Systemtic Name: 2-[4-(2-azanylethylamino)phthalazin-1-yl]ethanenitrile Openeye Name: 2-[4-(2-aminoethylamino)phthalazin-1-yl]acetonitrile CAS Name: 2-[4-(2-aminoethylamino)-1-phthalazinyl]acetonitrile IUPAC Name: 2-[4-(2-aminoethylamino)phthalazin-1-yl]acetonitrile Traditional Name: 2-[4-(2-aminoethylamino)phthalazin-1-yl]acetonitrile Formula: C12H13N5 MolecularWeight: 227.26512

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NN=C2NCCN)CC#N

Isomeric SMILES

C1=CC=C2C(=C1)C(=NN=C2NCCN)CC#N

InChI

InChI=1S/C12H13N5/c13-6-5-11-9-3-1-2-4-10(9)12(17-16-11)15-8-7-14/h1-4H,5,7-8,14H2,(H,15,17)