2-[2-(4-nitrophenyl)ethyl]-4-phenyl-phthalazin-1-one

Systemtic Name: 2-[2-(4-nitrophenyl)ethyl]-4-phenyl-phthalazin-1-one Openeye Name: 2-[2-(4-nitrophenyl)ethyl]-4-phenyl-phthalazin-1-one CAS Name: 2-[2-(4-nitrophenyl)ethyl]-4-phenyl-1-phthalazinone IUPAC Name: 2-[2-(4-nitrophenyl)ethyl]-4-phenylphthalazin-1-one Traditional Name: 2-[2-(4-nitrophenyl)ethyl]-4-phenyl-phthalazin-1-one Formula: C22H17N3O3 MolecularWeight: 371.38868

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NN(C(=O)C3=CC=CC=C32)CCC4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C2=NN(C(=O)C3=CC=CC=C32)CCC4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C22H17N3O3/c26-22-20-9-5-4-8-19(20)21(17-6-2-1-3-7-17)23-24(22)15-14-16-10-12-18(13-11-16)25(27)28/h1-13H,14-15H2