4-(4-methoxy-3-nitro-phenyl)-N-phenyl-phthalazin-1-amine

Systemtic Name: 4-(4-methoxy-3-nitro-phenyl)-N-phenyl-phthalazin-1-amine Openeye Name: 4-(4-methoxy-3-nitro-phenyl)-N-phenyl-phthalazin-1-amine CAS Name: 4-(4-methoxy-3-nitrophenyl)-N-phenyl-1-phthalazinamine IUPAC Name: 4-(4-methoxy-3-nitrophenyl)-N-phenylphthalazin-1-amine Traditional Name: [4-(4-methoxy-3-nitro-phenyl)phthalazin-1-yl]-phenyl-amine Formula: C21H16N4O3 MolecularWeight: 372.37674

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NN=C(C3=CC=CC=C32)NC4=CC=CC=C4)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NN=C(C3=CC=CC=C32)NC4=CC=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H16N4O3/c1-28-19-12-11-14(13-18(19)25(26)27)20-16-9-5-6-10-17(16)21(24-23-20)22-15-7-3-2-4-8-15/h2-13H,1H3,(H,22,24)