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

Systemtic Name: 4-[4-(2-dimethylaminoethylamino)-3-nitro-phenyl]-2-methyl-phthalazin-1-one Openeye Name: 4-[4-(2-dimethylaminoethylamino)-3-nitro-phenyl]-2-methyl-phthalazin-1-one CAS Name: 4-[4-(2-dimethylaminoethylamino)-3-nitrophenyl]-2-methyl-1-phthalazinone IUPAC Name: 4-[4-(2-dimethylaminoethylamino)-3-nitrophenyl]-2-methylphthalazin-1-one Traditional Name: 4-[4-(2-dimethylaminoethylamino)-3-nitro-phenyl]-2-methyl-phthalazin-1-one Formula: C19H21N5O3 MolecularWeight: 367.40174

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H21N5O3/c1-22(2)11-10-20-16-9-8-13(12-17(16)24(26)27)18-14-6-4-5-7-15(14)19(25)23(3)21-18/h4-9,12,20H,10-11H2,1-3H3