N-[(Z)-[5-chloranyl-3-methyl-1-(2-methylpropyl)pyrazol-4-yl]methylideneamino]-3-nitro-benzamide

Systemtic Name: N-[(Z)-[5-chloranyl-3-methyl-1-(2-methylpropyl)pyrazol-4-yl]methylideneamino]-3-nitro-benzamide Openeye Name: N-[(Z)-(5-chloro-1-isobutyl-3-methyl-pyrazol-4-yl)methyleneamino]-3-nitro-benzamide CAS Name: N-[(Z)-[5-chloro-3-methyl-1-(2-methylpropyl)-4-pyrazolyl]methylideneamino]-3-nitrobenzamide IUPAC Name: N-[(Z)-[5-chloro-3-methyl-1-(2-methylpropyl)pyrazol-4-yl]methylideneamino]-3-nitrobenzamide Traditional Name: N-[(Z)-(5-chloro-1-isobutyl-3-methyl-pyrazol-4-yl)methyleneamino]-3-nitro-benzamide Formula: C16H18ClN5O3 MolecularWeight: 363.79882

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H18ClN5O3/c1-10(2)9-21-15(17)14(11(3)20-21)8-18-19-16(23)12-5-4-6-13(7-12)22(24)25/h4-8,10H,9H2,1-3H3,(H,19,23)/b18-8-