N-ethyl-N-[3-[(3E)-3-[(4-isocyano-1H-pyrazol-5-yl)imino]propanoyl]phenyl]ethanamide

Systemtic Name: N-ethyl-N-[3-[(3E)-3-[(4-isocyano-1H-pyrazol-5-yl)imino]propanoyl]phenyl]ethanamide Openeye Name: N-ethyl-N-[3-[(3E)-3-[(4-isocyano-1H-pyrazol-5-yl)imino]propanoyl]phenyl]acetamide CAS Name: N-ethyl-N-[3-[(3E)-3-[(4-isocyano-1H-pyrazol-5-yl)imino]-1-oxopropyl]phenyl]acetamide IUPAC Name: N-ethyl-N-[3-[(3E)-3-[(4-isocyano-1H-pyrazol-5-yl)imino]propanoyl]phenyl]acetamide Traditional Name: N-ethyl-N-[3-[(3E)-3-[(4-isocyano-1H-pyrazol-5-yl)imino]propanoyl]phenyl]acetamide Formula: C17H17N5O2 MolecularWeight: 323.34918

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC=CC(=C1)C(=O)CC=NC2=C(C=NN2)[N+]#[C-])C(=O)C

Isomeric SMILES

CCN(C1=CC=CC(=C1)C(=O)C/C=N/C2=C(C=NN2)[N+]#[C-])C(=O)C

InChI

InChI=1S/C17H17N5O2/c1-4-22(12(2)23)14-7-5-6-13(10-14)16(24)8-9-19-17-15(18-3)11-20-21-17/h5-7,9-11H,4,8H2,1-2H3,(H,20,21)/b19-9+