(E)-3-(1,3-benzodioxol-5-yl)-N-(2-methyl-4-pyrrolidin-1-yl-phenyl)prop-2-enamide

Systemtic Name: (E)-3-(1,3-benzodioxol-5-yl)-N-(2-methyl-4-pyrrolidin-1-yl-phenyl)prop-2-enamide Openeye Name: (E)-3-(1,3-benzodioxol-5-yl)-N-(2-methyl-4-pyrrolidin-1-yl-phenyl)prop-2-enamide CAS Name: (E)-3-(1,3-benzodioxol-5-yl)-N-[2-methyl-4-(1-pyrrolidinyl)phenyl]-2-propenamide IUPAC Name: (E)-3-(1,3-benzodioxol-5-yl)-N-(2-methyl-4-pyrrolidin-1-ylphenyl)prop-2-enamide Traditional Name: (E)-3-(1,3-benzodioxol-5-yl)-N-(2-methyl-4-pyrrolidino-phenyl)acrylamide Formula: C21H22N2O3 MolecularWeight: 350.41098

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)N2CCCC2)NC(=O)C=CC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC1=C(C=CC(=C1)N2CCCC2)NC(=O)/C=C/C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C21H22N2O3/c1-15-12-17(23-10-2-3-11-23)6-7-18(15)22-21(24)9-5-16-4-8-19-20(13-16)26-14-25-19/h4-9,12-13H,2-3,10-11,14H2,1H3,(H,22,24)/b9-5+