(6E)-2,4-dimethyl-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)-2,4-dimethyl-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)-2,4-dimethyl-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)-2,4-dimethyl-6-[5-(2-methyl-4-nitro-5-propyl-3-pyrazolyl)-1,2-dihydropyrazol-3-ylidene]-1-cyclohexa-2,4-dienone IUPAC Name: (6E)-2,4-dimethyl-6-[5-(2-methyl-4-nitro-5-propylpyrazol-3-yl)-1,2-dihydropyrazol-3-ylidene]cyclohexa-2,4-dien-1-one Traditional Name: (6E)-2,4-dimethyl-6-[5-(2-methyl-4-nitro-5-propyl-pyrazol-3-yl)-3-pyrazolin-3-ylidene]cyclohexa-2,4-dien-1-one Formula: C18H21N5O3 MolecularWeight: 355.39104

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN(C(=C1[N+](=O)[O-])C2=CC(=C3C=C(C=C(C3=O)C)C)NN2)C

Isomeric SMILES

CCCC1=NN(C(=C1[N+](=O)[O-])C2=C/C(=C\3/C=C(C=C(C3=O)C)C)/NN2)C

InChI

InChI=1S/C18H21N5O3/c1-5-6-13-17(23(25)26)16(22(4)21-13)15-9-14(19-20-15)12-8-10(2)7-11(3)18(12)24/h7-9,19-20H,5-6H2,1-4H3/b14-12+