(Z)-3-[5-chloranyl-3-methyl-1-(2-methylpropyl)pyrazol-4-yl]-2-(4-nitrophenyl)prop-2-enenitrile

Systemtic Name: (Z)-3-[5-chloranyl-3-methyl-1-(2-methylpropyl)pyrazol-4-yl]-2-(4-nitrophenyl)prop-2-enenitrile Openeye Name: (Z)-3-(5-chloro-1-isobutyl-3-methyl-pyrazol-4-yl)-2-(4-nitrophenyl)prop-2-enenitrile CAS Name: (Z)-3-[5-chloro-3-methyl-1-(2-methylpropyl)-4-pyrazolyl]-2-(4-nitrophenyl)-2-propenenitrile IUPAC Name: (Z)-3-[5-chloro-3-methyl-1-(2-methylpropyl)pyrazol-4-yl]-2-(4-nitrophenyl)prop-2-enenitrile Traditional Name: (Z)-3-(5-chloro-1-isobutyl-3-methyl-pyrazol-4-yl)-2-(4-nitrophenyl)acrylonitrile Formula: C17H17ClN4O2 MolecularWeight: 344.79548

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H17ClN4O2/c1-11(2)10-21-17(18)16(12(3)20-21)8-14(9-19)13-4-6-15(7-5-13)22(23)24/h4-8,11H,10H2,1-3H3/b14-8+