(6E)-4-methyl-6-[5-(2-methyl-4-nitro-5-propyl-pyrazol-3-yl)-1,2-dihydropyrazol-3-ylidene]cyclohexa-2,4-dien-1-one

Systemtic Name: (6E)-4-methyl-6-[5-(2-methyl-4-nitro-5-propyl-pyrazol-3-yl)-1,2-dihydropyrazol-3-ylidene]cyclohexa-2,4-dien-1-one Openeye Name: (6E)-4-methyl-6-[5-(2-methyl-4-nitro-5-propyl-pyrazol-3-yl)-1,2-dihydropyrazol-3-ylidene]cyclohexa-2,4-dien-1-one CAS Name: (6E)-4-methyl-6-[5-(2-methyl-4-nitro-5-propyl-3-pyrazolyl)-1,2-dihydropyrazol-3-ylidene]-1-cyclohexa-2,4-dienone IUPAC Name: (6E)-4-methyl-6-[5-(2-methyl-4-nitro-5-propylpyrazol-3-yl)-1,2-dihydropyrazol-3-ylidene]cyclohexa-2,4-dien-1-one Traditional Name: (6E)-4-methyl-6-[5-(2-methyl-4-nitro-5-propyl-pyrazol-3-yl)-3-pyrazolin-3-ylidene]cyclohexa-2,4-dien-1-one Formula: C17H19N5O3 MolecularWeight: 341.36446

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN(C(=C1[N+](=O)[O-])C2=CC(=C3C=C(C=CC3=O)C)NN2)C

Isomeric SMILES

CCCC1=NN(C(=C1[N+](=O)[O-])C2=C/C(=C\3/C=C(C=CC3=O)C)/NN2)C

InChI

InChI=1S/C17H19N5O3/c1-4-5-12-17(22(24)25)16(21(3)20-12)14-9-13(18-19-14)11-8-10(2)6-7-15(11)23/h6-9,18-19H,4-5H2,1-3H3/b13-11+