(E)-N-(1,3-benzodioxol-5-yl)-3-[1-(phenylmethyl)pyrazol-4-yl]prop-2-enamide

Systemtic Name: (E)-N-(1,3-benzodioxol-5-yl)-3-[1-(phenylmethyl)pyrazol-4-yl]prop-2-enamide Openeye Name: (E)-N-(1,3-benzodioxol-5-yl)-3-(1-benzylpyrazol-4-yl)prop-2-enamide CAS Name: (E)-N-(1,3-benzodioxol-5-yl)-3-[1-(phenylmethyl)-4-pyrazolyl]-2-propenamide IUPAC Name: (E)-N-(1,3-benzodioxol-5-yl)-3-(1-benzylpyrazol-4-yl)prop-2-enamide Traditional Name: (E)-N-(1,3-benzodioxol-5-yl)-3-(1-benzylpyrazol-4-yl)acrylamide Formula: C20H17N3O3 MolecularWeight: 347.36728

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)NC(=O)C=CC3=CN(N=C3)CC4=CC=CC=C4

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)NC(=O)/C=C/C3=CN(N=C3)CC4=CC=CC=C4

InChI

InChI=1S/C20H17N3O3/c24-20(22-17-7-8-18-19(10-17)26-14-25-18)9-6-16-11-21-23(13-16)12-15-4-2-1-3-5-15/h1-11,13H,12,14H2,(H,22,24)/b9-6+