4-methyl-2-[(4-nitrophenyl)methyl]phthalazin-1-one

Systemtic Name: 4-methyl-2-[(4-nitrophenyl)methyl]phthalazin-1-one Openeye Name: 4-methyl-2-[(4-nitrophenyl)methyl]phthalazin-1-one CAS Name: 4-methyl-2-[(4-nitrophenyl)methyl]-1-phthalazinone IUPAC Name: 4-methyl-2-[(4-nitrophenyl)methyl]phthalazin-1-one Traditional Name: 4-methyl-2-(4-nitrobenzyl)phthalazin-1-one Formula: C16H13N3O3 MolecularWeight: 295.29272

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C2=CC=CC=C12)CC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=NN(C(=O)C2=CC=CC=C12)CC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C16H13N3O3/c1-11-14-4-2-3-5-15(14)16(20)18(17-11)10-12-6-8-13(9-7-12)19(21)22/h2-9H,10H2,1H3