1-[2-bromanyl-4-[(E)-(phthalazin-1-ylhydrazinylidene)methyl]phenoxy]-3-(propan-2-ylamino)propan-2-ol

Systemtic Name: 1-[2-bromanyl-4-[(E)-(phthalazin-1-ylhydrazinylidene)methyl]phenoxy]-3-(propan-2-ylamino)propan-2-ol Openeye Name: 1-[2-bromo-4-[(E)-(phthalazin-1-ylhydrazono)methyl]phenoxy]-3-(isopropylamino)propan-2-ol CAS Name: 1-[2-bromo-4-[(E)-(1-phthalazinylhydrazinylidene)methyl]phenoxy]-3-(propan-2-ylamino)-2-propanol IUPAC Name: 1-[2-bromo-4-[(E)-(phthalazin-1-ylhydrazinylidene)methyl]phenoxy]-3-(propan-2-ylamino)propan-2-ol Traditional Name: 1-[2-bromo-4-[(E)-(phthalazin-1-ylhydrazono)methyl]phenoxy]-3-(isopropylamino)propan-2-ol Formula: C21H24BrN5O2 MolecularWeight: 458.35156

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NCC(COC1=C(C=C(C=C1)C=NNC2=NN=CC3=CC=CC=C32)Br)O

Isomeric SMILES

CC(C)NCC(COC1=C(C=C(C=C1)/C=N/NC2=NN=CC3=CC=CC=C32)Br)O

InChI

InChI=1S/C21H24BrN5O2/c1-14(2)23-12-17(28)13-29-20-8-7-15(9-19(20)22)10-24-26-21-18-6-4-3-5-16(18)11-25-27-21/h3-11,14,17,23,28H,12-13H2,1-2H3,(H,26,27)/b24-10+