5-[(4-chloranyl-5-methyl-3-nitro-pyrazol-1-yl)methyl]-N-[(E)-(2-methylphenyl)methylideneamino]furan-2-carboxamide

Systemtic Name: 5-[(4-chloranyl-5-methyl-3-nitro-pyrazol-1-yl)methyl]-N-[(E)-(2-methylphenyl)methylideneamino]furan-2-carboxamide Openeye Name: 5-[(4-chloro-5-methyl-3-nitro-pyrazol-1-yl)methyl]-N-[(E)-o-tolylmethyleneamino]furan-2-carboxamide CAS Name: 5-[(4-chloro-5-methyl-3-nitro-1-pyrazolyl)methyl]-N-[(E)-(2-methylphenyl)methylideneamino]-2-furancarboxamide IUPAC Name: 5-[(4-chloro-5-methyl-3-nitropyrazol-1-yl)methyl]-N-[(E)-(2-methylphenyl)methylideneamino]furan-2-carboxamide Traditional Name: 5-[(4-chloro-5-methyl-3-nitro-pyrazol-1-yl)methyl]-N-[(E)-(2-methylbenzylidene)amino]-2-furamide Formula: C18H16ClN5O4 MolecularWeight: 401.80374

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C=NNC(=O)C2=CC=C(O2)CN3C(=C(C(=N3)[N+](=O)[O-])Cl)C

Isomeric SMILES

CC1=CC=CC=C1/C=N/NC(=O)C2=CC=C(O2)CN3C(=C(C(=N3)[N+](=O)[O-])Cl)C

InChI

InChI=1S/C18H16ClN5O4/c1-11-5-3-4-6-13(11)9-20-21-18(25)15-8-7-14(28-15)10-23-12(2)16(19)17(22-23)24(26)27/h3-9H,10H2,1-2H3,(H,21,25)/b20-9+