2-[(3-nitrophenyl)methylideneamino]-4-(phenylmethyl)phthalazin-1-one

Systemtic Name: 2-[(3-nitrophenyl)methylideneamino]-4-(phenylmethyl)phthalazin-1-one Openeye Name: 4-benzyl-2-[(3-nitrophenyl)methyleneamino]phthalazin-1-one CAS Name: 2-[(3-nitrophenyl)methylideneamino]-4-(phenylmethyl)-1-phthalazinone IUPAC Name: 4-benzyl-2-[(3-nitrophenyl)methylideneamino]phthalazin-1-one Traditional Name: 4-benzyl-2-[(3-nitrobenzylidene)amino]phthalazin-1-one Formula: C22H16N4O3 MolecularWeight: 384.38744

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=NN(C(=O)C3=CC=CC=C32)N=CC4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CC2=NN(C(=O)C3=CC=CC=C32)N=CC4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C22H16N4O3/c27-22-20-12-5-4-11-19(20)21(14-16-7-2-1-3-8-16)24-25(22)23-15-17-9-6-10-18(13-17)26(28)29/h1-13,15H,14H2