2-[(2E)-2-[1-(4-chloranyl-3-nitro-phenyl)ethylidene]hydrazinyl]-6-methyl-1H-pyrimidin-4-one

Systemtic Name: 2-[(2E)-2-[1-(4-chloranyl-3-nitro-phenyl)ethylidene]hydrazinyl]-6-methyl-1H-pyrimidin-4-one Openeye Name: 2-[(2E)-2-[1-(4-chloro-3-nitro-phenyl)ethylidene]hydrazino]-6-methyl-1H-pyrimidin-4-one CAS Name: 2-[(2E)-2-[1-(4-chloro-3-nitrophenyl)ethylidene]hydrazinyl]-6-methyl-1H-pyrimidin-4-one IUPAC Name: 2-[(2E)-2-[1-(4-chloro-3-nitrophenyl)ethylidene]hydrazinyl]-6-methyl-1H-pyrimidin-4-one Traditional Name: 2-[(N'E)-N'-[1-(4-chloro-3-nitro-phenyl)ethylidene]hydrazino]-6-methyl-1H-pyrimidin-4-one Formula: C13H12ClN5O3 MolecularWeight: 321.71908

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)N=C(N1)NN=C(C)C2=CC(=C(C=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=O)N=C(N1)N/N=C(\C)/C2=CC(=C(C=C2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C13H12ClN5O3/c1-7-5-12(20)16-13(15-7)18-17-8(2)9-3-4-10(14)11(6-9)19(21)22/h3-6H,1-2H3,(H2,15,16,18,20)/b17-8+