(E)-3-(1,3-benzodioxol-5-yl)-N-(2-phenyl-2-pyrrolidin-1-yl-ethyl)prop-2-enamide

Systemtic Name: (E)-3-(1,3-benzodioxol-5-yl)-N-(2-phenyl-2-pyrrolidin-1-yl-ethyl)prop-2-enamide Openeye Name: (E)-3-(1,3-benzodioxol-5-yl)-N-(2-phenyl-2-pyrrolidin-1-yl-ethyl)prop-2-enamide CAS Name: (E)-3-(1,3-benzodioxol-5-yl)-N-[2-phenyl-2-(1-pyrrolidinyl)ethyl]-2-propenamide IUPAC Name: (E)-3-(1,3-benzodioxol-5-yl)-N-(2-phenyl-2-pyrrolidin-1-ylethyl)prop-2-enamide Traditional Name: (E)-3-(1,3-benzodioxol-5-yl)-N-(2-phenyl-2-pyrrolidino-ethyl)acrylamide Formula: C22H24N2O3 MolecularWeight: 364.43756

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(CNC(=O)C=CC2=CC3=C(C=C2)OCO3)C4=CC=CC=C4

Isomeric SMILES

C1CCN(C1)C(CNC(=O)/C=C/C2=CC3=C(C=C2)OCO3)C4=CC=CC=C4

InChI

InChI=1S/C22H24N2O3/c25-22(11-9-17-8-10-20-21(14-17)27-16-26-20)23-15-19(24-12-4-5-13-24)18-6-2-1-3-7-18/h1-3,6-11,14,19H,4-5,12-13,15-16H2,(H,23,25)/b11-9+