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

Systemtic Name: N-(3-chlorophenyl)-4-(4-methoxy-3-nitro-phenyl)phthalazin-1-amine Openeye Name: N-(3-chlorophenyl)-4-(4-methoxy-3-nitro-phenyl)phthalazin-1-amine CAS Name: N-(3-chlorophenyl)-4-(4-methoxy-3-nitrophenyl)-1-phthalazinamine IUPAC Name: N-(3-chlorophenyl)-4-(4-methoxy-3-nitrophenyl)phthalazin-1-amine Traditional Name: (3-chlorophenyl)-[4-(4-methoxy-3-nitro-phenyl)phthalazin-1-yl]amine Formula: C21H15ClN4O3 MolecularWeight: 406.8218

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H15ClN4O3/c1-29-19-10-9-13(11-18(19)26(27)28)20-16-7-2-3-8-17(16)21(25-24-20)23-15-6-4-5-14(22)12-15/h2-12H,1H3,(H,23,25)