4-[4-[(4-methoxyphenyl)amino]-3-nitro-phenyl]-2-methyl-phthalazin-1-one

Systemtic Name: 4-[4-[(4-methoxyphenyl)amino]-3-nitro-phenyl]-2-methyl-phthalazin-1-one Openeye Name: 4-[4-(4-methoxyanilino)-3-nitro-phenyl]-2-methyl-phthalazin-1-one CAS Name: 4-[4-(4-methoxyanilino)-3-nitrophenyl]-2-methyl-1-phthalazinone IUPAC Name: 4-[4-(4-methoxyanilino)-3-nitrophenyl]-2-methylphthalazin-1-one Traditional Name: 2-methyl-4-[3-nitro-4-(p-anisidino)phenyl]phthalazin-1-one Formula: C22H18N4O4 MolecularWeight: 402.40272

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=CC=CC=C2C(=N1)C3=CC(=C(C=C3)NC4=CC=C(C=C4)OC)[N+](=O)[O-]

Isomeric SMILES

CN1C(=O)C2=CC=CC=C2C(=N1)C3=CC(=C(C=C3)NC4=CC=C(C=C4)OC)[N+](=O)[O-]

InChI

InChI=1S/C22H18N4O4/c1-25-22(27)18-6-4-3-5-17(18)21(24-25)14-7-12-19(20(13-14)26(28)29)23-15-8-10-16(30-2)11-9-15/h3-13,23H,1-2H3