(E)-N-heptan-2-yl-3-(1-phenylpyrazol-4-yl)prop-2-enamide

Systemtic Name: (E)-N-heptan-2-yl-3-(1-phenylpyrazol-4-yl)prop-2-enamide Openeye Name: (E)-N-(1-methylhexyl)-3-(1-phenylpyrazol-4-yl)prop-2-enamide CAS Name: (E)-N-heptan-2-yl-3-(1-phenyl-4-pyrazolyl)-2-propenamide IUPAC Name: (E)-N-heptan-2-yl-3-(1-phenylpyrazol-4-yl)prop-2-enamide Traditional Name: (E)-N-(1-methylhexyl)-3-(1-phenylpyrazol-4-yl)acrylamide Formula: C19H25N3O MolecularWeight: 311.4213

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)NC(=O)C=CC1=CN(N=C1)C2=CC=CC=C2

Isomeric SMILES

CCCCCC(C)NC(=O)/C=C/C1=CN(N=C1)C2=CC=CC=C2

InChI

InChI=1S/C19H25N3O/c1-3-4-6-9-16(2)21-19(23)13-12-17-14-20-22(15-17)18-10-7-5-8-11-18/h5,7-8,10-16H,3-4,6,9H2,1-2H3,(H,21,23)/b13-12+