N-[(E)-butan-2-ylideneamino]-4-chloranyl-phthalazin-1-amine

Systemtic Name: N-[(E)-butan-2-ylideneamino]-4-chloranyl-phthalazin-1-amine Openeye Name: 4-chloro-N-[(E)-1-methylpropylideneamino]phthalazin-1-amine CAS Name: N-[(E)-butan-2-ylideneamino]-4-chloro-1-phthalazinamine IUPAC Name: N-[(E)-butan-2-ylideneamino]-4-chlorophthalazin-1-amine Traditional Name: (4-chlorophthalazin-1-yl)-[(E)-1-methylpropylideneamino]amine Formula: C12H13ClN4 MolecularWeight: 248.71142

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=NNC1=NN=C(C2=CC=CC=C21)Cl)C

Isomeric SMILES

CC/C(=N/NC1=NN=C(C2=CC=CC=C21)Cl)/C

InChI

InChI=1S/C12H13ClN4/c1-3-8(2)14-16-12-10-7-5-4-6-9(10)11(13)15-17-12/h4-7H,3H2,1-2H3,(H,16,17)/b14-8+