N-[(E)-(5-chloranyl-3-methyl-1-phenyl-pyrazol-4-yl)methylideneamino]-3-nitro-aniline

Systemtic Name: N-[(E)-(5-chloranyl-3-methyl-1-phenyl-pyrazol-4-yl)methylideneamino]-3-nitro-aniline Openeye Name: N-[(E)-(5-chloro-3-methyl-1-phenyl-pyrazol-4-yl)methyleneamino]-3-nitro-aniline CAS Name: N-[(E)-(5-chloro-3-methyl-1-phenyl-4-pyrazolyl)methylideneamino]-3-nitroaniline IUPAC Name: N-[(E)-(5-chloro-3-methyl-1-phenylpyrazol-4-yl)methylideneamino]-3-nitroaniline Traditional Name: [(E)-(5-chloro-3-methyl-1-phenyl-pyrazol-4-yl)methyleneamino]-(3-nitrophenyl)amine Formula: C17H14ClN5O2 MolecularWeight: 355.77836

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C=NNC2=CC(=CC=C2)[N+](=O)[O-])Cl)C3=CC=CC=C3

Isomeric SMILES

CC1=NN(C(=C1/C=N/NC2=CC(=CC=C2)[N+](=O)[O-])Cl)C3=CC=CC=C3

InChI

InChI=1S/C17H14ClN5O2/c1-12-16(17(18)22(21-12)14-7-3-2-4-8-14)11-19-20-13-6-5-9-15(10-13)23(24)25/h2-11,20H,1H3/b19-11+