3-methyl-5-[[(E)-1-nitroso-2-(oxidanylamino)-2-phenyl-ethenyl]amino]-1,2-oxazole-4-carbonitrile

Systemtic Name: 3-methyl-5-[[(E)-1-nitroso-2-(oxidanylamino)-2-phenyl-ethenyl]amino]-1,2-oxazole-4-carbonitrile Openeye Name: 5-[[(E)-2-(hydroxyamino)-1-nitroso-2-phenyl-vinyl]amino]-3-methyl-isoxazole-4-carbonitrile CAS Name: 5-[[(E)-2-(hydroxyamino)-1-nitroso-2-phenylethenyl]amino]-3-methyl-4-isoxazolecarbonitrile IUPAC Name: 5-[[(E)-2-(hydroxyamino)-1-nitroso-2-phenylethenyl]amino]-3-methyl-1,2-oxazole-4-carbonitrile Traditional Name: 5-[[(E)-2-(hydroxyamino)-1-nitroso-2-phenyl-vinyl]amino]-3-methyl-isoxazole-4-carbonitrile Formula: C13H11N5O3 MolecularWeight: 285.25814

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NOC(=C1C#N)NC(=C(C2=CC=CC=C2)NO)N=O

Isomeric SMILES

CC1=NOC(=C1C#N)N/C(=C(/C2=CC=CC=C2)\NO)/N=O

InChI

InChI=1S/C13H11N5O3/c1-8-10(7-14)13(21-18-8)15-12(17-20)11(16-19)9-5-3-2-4-6-9/h2-6,15-16,19H,1H3/b12-11+