5-methyl-4-[(E)-[3-(3-nitrophenyl)pyrazol-4-ylidene]methyl]-1,2-dihydropyrazol-3-one

Systemtic Name: 5-methyl-4-[(E)-[3-(3-nitrophenyl)pyrazol-4-ylidene]methyl]-1,2-dihydropyrazol-3-one Openeye Name: 5-methyl-4-[(E)-[3-(3-nitrophenyl)pyrazol-4-ylidene]methyl]-1,2-dihydropyrazol-3-one CAS Name: 5-methyl-4-[(E)-[3-(3-nitrophenyl)-4-pyrazolylidene]methyl]-1,2-dihydropyrazol-3-one IUPAC Name: 5-methyl-4-[(E)-[3-(3-nitrophenyl)pyrazol-4-ylidene]methyl]-1,2-dihydropyrazol-3-one Traditional Name: 5-methyl-4-[(E)-[3-(3-nitrophenyl)pyrazol-4-ylidene]methyl]-3-pyrazolin-3-one Formula: C14H11N5O3 MolecularWeight: 297.26884

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)NN1)C=C2C=NN=C2C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=O)NN1)/C=C/2\C=NN=C2C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C14H11N5O3/c1-8-12(14(20)18-16-8)6-10-7-15-17-13(10)9-3-2-4-11(5-9)19(21)22/h2-7H,1H3,(H2,16,18,20)/b10-6+