(E)-N-(2-chloranyl-5-nitro-phenyl)-2-cyano-3-[5-(4-methylphenyl)-1H-pyrazol-4-yl]prop-2-enamide

Systemtic Name: (E)-N-(2-chloranyl-5-nitro-phenyl)-2-cyano-3-[5-(4-methylphenyl)-1H-pyrazol-4-yl]prop-2-enamide Openeye Name: (E)-N-(2-chloro-5-nitro-phenyl)-2-cyano-3-[5-(p-tolyl)-1H-pyrazol-4-yl]prop-2-enamide CAS Name: (E)-N-(2-chloro-5-nitrophenyl)-2-cyano-3-[5-(4-methylphenyl)-1H-pyrazol-4-yl]-2-propenamide IUPAC Name: (E)-N-(2-chloro-5-nitrophenyl)-2-cyano-3-[5-(4-methylphenyl)-1H-pyrazol-4-yl]prop-2-enamide Traditional Name: (E)-N-(2-chloro-5-nitro-phenyl)-2-cyano-3-[5-(p-tolyl)-1H-pyrazol-4-yl]acrylamide Formula: C20H14ClN5O3 MolecularWeight: 407.80986

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(C=NN2)C=C(C#N)C(=O)NC3=C(C=CC(=C3)[N+](=O)[O-])Cl

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(C=NN2)/C=C(\C#N)/C(=O)NC3=C(C=CC(=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C20H14ClN5O3/c1-12-2-4-13(5-3-12)19-15(11-23-25-19)8-14(10-22)20(27)24-18-9-16(26(28)29)6-7-17(18)21/h2-9,11H,1H3,(H,23,25)(H,24,27)/b14-8+