N-(1,3-benzodioxol-5-yl)-4-(4-methoxyphenyl)phthalazin-1-amine

Systemtic Name: N-(1,3-benzodioxol-5-yl)-4-(4-methoxyphenyl)phthalazin-1-amine Openeye Name: N-(1,3-benzodioxol-5-yl)-4-(4-methoxyphenyl)phthalazin-1-amine CAS Name: N-(1,3-benzodioxol-5-yl)-4-(4-methoxyphenyl)-1-phthalazinamine IUPAC Name: N-(1,3-benzodioxol-5-yl)-4-(4-methoxyphenyl)phthalazin-1-amine Traditional Name: 1,3-benzodioxol-5-yl-[4-(4-methoxyphenyl)phthalazin-1-yl]amine Formula: C22H17N3O3 MolecularWeight: 371.38868

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NN=C(C3=CC=CC=C32)NC4=CC5=C(C=C4)OCO5

Isomeric SMILES

COC1=CC=C(C=C1)C2=NN=C(C3=CC=CC=C32)NC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C22H17N3O3/c1-26-16-9-6-14(7-10-16)21-17-4-2-3-5-18(17)22(25-24-21)23-15-8-11-19-20(12-15)28-13-27-19/h2-12H,13H2,1H3,(H,23,25)