N-[(E)-(3-fluorophenyl)methylideneamino]-1-[(4-methylphenyl)methyl]-4-nitro-pyrazole-3-carboxamide

Systemtic Name: N-[(E)-(3-fluorophenyl)methylideneamino]-1-[(4-methylphenyl)methyl]-4-nitro-pyrazole-3-carboxamide Openeye Name: N-[(E)-(3-fluorophenyl)methyleneamino]-4-nitro-1-(p-tolylmethyl)pyrazole-3-carboxamide CAS Name: N-[(E)-(3-fluorophenyl)methylideneamino]-1-[(4-methylphenyl)methyl]-4-nitro-3-pyrazolecarboxamide IUPAC Name: N-[(E)-(3-fluorophenyl)methylideneamino]-1-[(4-methylphenyl)methyl]-4-nitropyrazole-3-carboxamide Traditional Name: N-[(E)-(3-fluorobenzylidene)amino]-1-(4-methylbenzyl)-4-nitro-pyrazole-3-carboxamide Formula: C19H16FN5O3 MolecularWeight: 381.360443

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2C=C(C(=N2)C(=O)NN=CC3=CC(=CC=C3)F)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)CN2C=C(C(=N2)C(=O)N/N=C/C3=CC(=CC=C3)F)[N+](=O)[O-]

InChI

InChI=1S/C19H16FN5O3/c1-13-5-7-14(8-6-13)11-24-12-17(25(27)28)18(23-24)19(26)22-21-10-15-3-2-4-16(20)9-15/h2-10,12H,11H2,1H3,(H,22,26)/b21-10+