(E)-3-(1,3-benzodioxol-5-yl)-2-cyano-N-[(1R)-1-phenylethyl]prop-2-enamide

Systemtic Name: (E)-3-(1,3-benzodioxol-5-yl)-2-cyano-N-[(1R)-1-phenylethyl]prop-2-enamide Openeye Name: (E)-3-(1,3-benzodioxol-5-yl)-2-cyano-N-[(1R)-1-phenylethyl]prop-2-enamide CAS Name: (E)-3-(1,3-benzodioxol-5-yl)-2-cyano-N-[(1R)-1-phenylethyl]-2-propenamide IUPAC Name: (E)-3-(1,3-benzodioxol-5-yl)-2-cyano-N-[(1R)-1-phenylethyl]prop-2-enamide Traditional Name: (E)-3-(1,3-benzodioxol-5-yl)-2-cyano-N-[(1R)-1-phenylethyl]acrylamide Formula: C19H16N2O3 MolecularWeight: 320.34194

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC(=O)C(=CC2=CC3=C(C=C2)OCO3)C#N

Isomeric SMILES

C[C@H](C1=CC=CC=C1)NC(=O)/C(=C/C2=CC3=C(C=C2)OCO3)/C#N

InChI

InChI=1S/C19H16N2O3/c1-13(15-5-3-2-4-6-15)21-19(22)16(11-20)9-14-7-8-17-18(10-14)24-12-23-17/h2-10,13H,12H2,1H3,(H,21,22)/b16-9+/t13-/m1/s1