N1-(2H-benzotriazol-5-yl)-N4-(4-chlorophenyl)phthalazine-1,4-diamine

Systemtic Name: N1-(2H-benzotriazol-5-yl)-N4-(4-chlorophenyl)phthalazine-1,4-diamine Openeye Name: N1-(2H-benzotriazol-5-yl)-N4-(4-chlorophenyl)phthalazine-1,4-diamine CAS Name: N1-(2H-benzotriazol-5-yl)-N4-(4-chlorophenyl)phthalazine-1,4-diamine IUPAC Name: 1-N-(2H-benzotriazol-5-yl)-4-N-(4-chlorophenyl)phthalazine-1,4-diamine Traditional Name: 2H-benzotriazol-5-yl-[4-(4-chloroanilino)phthalazin-1-yl]amine Formula: C20H14ClN7 MolecularWeight: 387.82506

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NN=C2NC3=CC4=NNN=C4C=C3)NC5=CC=C(C=C5)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C(=NN=C2NC3=CC4=NNN=C4C=C3)NC5=CC=C(C=C5)Cl

InChI

InChI=1S/C20H14ClN7/c21-12-5-7-13(8-6-12)22-19-15-3-1-2-4-16(15)20(27-26-19)23-14-9-10-17-18(11-14)25-28-24-17/h1-11H,(H,22,26)(H,23,27)(H,24,25,28)