N-[(Z)-(1-butyl-5-chloranyl-3-methyl-pyrazol-4-yl)methylideneamino]-2,4-dinitro-aniline

Systemtic Name: N-[(Z)-(1-butyl-5-chloranyl-3-methyl-pyrazol-4-yl)methylideneamino]-2,4-dinitro-aniline Openeye Name: N-[(Z)-(1-butyl-5-chloro-3-methyl-pyrazol-4-yl)methyleneamino]-2,4-dinitro-aniline CAS Name: N-[(Z)-(1-butyl-5-chloro-3-methyl-4-pyrazolyl)methylideneamino]-2,4-dinitroaniline IUPAC Name: N-[(Z)-(1-butyl-5-chloro-3-methylpyrazol-4-yl)methylideneamino]-2,4-dinitroaniline Traditional Name: [(Z)-(1-butyl-5-chloro-3-methyl-pyrazol-4-yl)methyleneamino]-(2,4-dinitrophenyl)amine Formula: C15H17ClN6O4 MolecularWeight: 380.78628

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(=N1)C)C=NNC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-])Cl

Isomeric SMILES

CCCCN1C(=C(C(=N1)C)/C=N\NC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-])Cl

InChI

InChI=1S/C15H17ClN6O4/c1-3-4-7-20-15(16)12(10(2)19-20)9-17-18-13-6-5-11(21(23)24)8-14(13)22(25)26/h5-6,8-9,18H,3-4,7H2,1-2H3/b17-9-