(E)-2-cyano-3-(7-methoxy-1,3-benzodioxol-5-yl)-N-(phenylmethyl)prop-2-enamide

Systemtic Name: (E)-2-cyano-3-(7-methoxy-1,3-benzodioxol-5-yl)-N-(phenylmethyl)prop-2-enamide Openeye Name: (E)-N-benzyl-2-cyano-3-(7-methoxy-1,3-benzodioxol-5-yl)prop-2-enamide CAS Name: (E)-2-cyano-3-(7-methoxy-1,3-benzodioxol-5-yl)-N-(phenylmethyl)-2-propenamide IUPAC Name: (E)-N-benzyl-2-cyano-3-(7-methoxy-1,3-benzodioxol-5-yl)prop-2-enamide Traditional Name: (E)-N-benzyl-2-cyano-3-(7-methoxy-1,3-benzodioxol-5-yl)acrylamide Formula: C19H16N2O4 MolecularWeight: 336.34134

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC2=C1OCO2)C=C(C#N)C(=O)NCC3=CC=CC=C3

Isomeric SMILES

COC1=CC(=CC2=C1OCO2)/C=C(\C#N)/C(=O)NCC3=CC=CC=C3

InChI

InChI=1S/C19H16N2O4/c1-23-16-8-14(9-17-18(16)25-12-24-17)7-15(10-20)19(22)21-11-13-5-3-2-4-6-13/h2-9H,11-12H2,1H3,(H,21,22)/b15-7+