4-chloranyl-N-hexadecyl-phthalazin-1-amine

Systemtic Name: 4-chloranyl-N-hexadecyl-phthalazin-1-amine Openeye Name: 4-chloro-N-hexadecyl-phthalazin-1-amine CAS Name: 4-chloro-N-hexadecyl-1-phthalazinamine IUPAC Name: 4-chloro-N-hexadecylphthalazin-1-amine Traditional Name: cetyl-(4-chlorophthalazin-1-yl)amine Formula: C24H38ClN3 MolecularWeight: 404.03162

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCNC1=NN=C(C2=CC=CC=C21)Cl

Isomeric SMILES

CCCCCCCCCCCCCCCCNC1=NN=C(C2=CC=CC=C21)Cl

InChI

InChI=1S/C24H38ClN3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-17-20-26-24-22-19-16-15-18-21(22)23(25)27-28-24/h15-16,18-19H,2-14,17,20H2,1H3,(H,26,28)