(E)-2-cyano-N-cyclopropyl-3-[4-methoxy-3-[(4-nitropyrazol-1-yl)methyl]phenyl]prop-2-enamide

Systemtic Name: (E)-2-cyano-N-cyclopropyl-3-[4-methoxy-3-[(4-nitropyrazol-1-yl)methyl]phenyl]prop-2-enamide Openeye Name: (E)-2-cyano-N-cyclopropyl-3-[4-methoxy-3-[(4-nitropyrazol-1-yl)methyl]phenyl]prop-2-enamide CAS Name: (E)-2-cyano-N-cyclopropyl-3-[4-methoxy-3-[(4-nitro-1-pyrazolyl)methyl]phenyl]-2-propenamide IUPAC Name: (E)-2-cyano-N-cyclopropyl-3-[4-methoxy-3-[(4-nitropyrazol-1-yl)methyl]phenyl]prop-2-enamide Traditional Name: (E)-2-cyano-N-cyclopropyl-3-[4-methoxy-3-[(4-nitropyrazol-1-yl)methyl]phenyl]acrylamide Formula: C18H17N5O4 MolecularWeight: 367.35868

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C=C(C#N)C(=O)NC2CC2)CN3C=C(C=N3)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)/C=C(\C#N)/C(=O)NC2CC2)CN3C=C(C=N3)[N+](=O)[O-]

InChI

InChI=1S/C18H17N5O4/c1-27-17-5-2-12(6-13(8-19)18(24)21-15-3-4-15)7-14(17)10-22-11-16(9-20-22)23(25)26/h2,5-7,9,11,15H,3-4,10H2,1H3,(H,21,24)/b13-6+