4-[3-[4-[2,4-bis(bromanyl)phenoxy]phenyl]butylamino]-2H-phthalazin-1-one

Systemtic Name: 4-[3-[4-[2,4-bis(bromanyl)phenoxy]phenyl]butylamino]-2H-phthalazin-1-one Openeye Name: 4-[3-[4-(2,4-dibromophenoxy)phenyl]butylamino]-2H-phthalazin-1-one CAS Name: 4-[3-[4-(2,4-dibromophenoxy)phenyl]butylamino]-2H-phthalazin-1-one IUPAC Name: 4-[3-[4-(2,4-dibromophenoxy)phenyl]butylamino]-2H-phthalazin-1-one Traditional Name: 4-[3-[4-(2,4-dibromophenoxy)phenyl]butylamino]-2H-phthalazin-1-one Formula: C24H21Br2N3O2 MolecularWeight: 543.25044

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCNC1=NNC(=O)C2=CC=CC=C21)C3=CC=C(C=C3)OC4=C(C=C(C=C4)Br)Br

Isomeric SMILES

CC(CCNC1=NNC(=O)C2=CC=CC=C21)C3=CC=C(C=C3)OC4=C(C=C(C=C4)Br)Br

InChI

InChI=1S/C24H21Br2N3O2/c1-15(12-13-27-23-19-4-2-3-5-20(19)24(30)29-28-23)16-6-9-18(10-7-16)31-22-11-8-17(25)14-21(22)26/h2-11,14-15H,12-13H2,1H3,(H,27,28)(H,29,30)