(E)-3-(3-nitrophenyl)-N-[[4-(pyrazol-1-ylmethyl)phenyl]methyl]prop-2-enamide

Systemtic Name: (E)-3-(3-nitrophenyl)-N-[[4-(pyrazol-1-ylmethyl)phenyl]methyl]prop-2-enamide Openeye Name: (E)-3-(3-nitrophenyl)-N-[[4-(pyrazol-1-ylmethyl)phenyl]methyl]prop-2-enamide CAS Name: (E)-3-(3-nitrophenyl)-N-[[4-(1-pyrazolylmethyl)phenyl]methyl]-2-propenamide IUPAC Name: (E)-3-(3-nitrophenyl)-N-[[4-(pyrazol-1-ylmethyl)phenyl]methyl]prop-2-enamide Traditional Name: (E)-3-(3-nitrophenyl)-N-[4-(pyrazol-1-ylmethyl)benzyl]acrylamide Formula: C20H18N4O3 MolecularWeight: 362.38192

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])C=CC(=O)NCC2=CC=C(C=C2)CN3C=CC=N3

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])/C=C/C(=O)NCC2=CC=C(C=C2)CN3C=CC=N3

InChI

InChI=1S/C20H18N4O3/c25-20(10-9-16-3-1-4-19(13-16)24(26)27)21-14-17-5-7-18(8-6-17)15-23-12-2-11-22-23/h1-13H,14-15H2,(H,21,25)/b10-9+