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

Systemtic Name: (E)-3-(1,3-benzodioxol-5-yl)-N-[4-methyl-3-(2-oxidanylidenepiperidin-1-yl)phenyl]prop-2-enamide Openeye Name: (E)-3-(1,3-benzodioxol-5-yl)-N-[4-methyl-3-(2-oxo-1-piperidyl)phenyl]prop-2-enamide CAS Name: (E)-3-(1,3-benzodioxol-5-yl)-N-[4-methyl-3-(2-oxo-1-piperidinyl)phenyl]-2-propenamide IUPAC Name: (E)-3-(1,3-benzodioxol-5-yl)-N-[4-methyl-3-(2-oxopiperidin-1-yl)phenyl]prop-2-enamide Traditional Name: (E)-3-(1,3-benzodioxol-5-yl)-N-[3-(2-ketopiperidino)-4-methyl-phenyl]acrylamide Formula: C22H22N2O4 MolecularWeight: 378.42108

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C=CC2=CC3=C(C=C2)OCO3)N4CCCCC4=O

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)/C=C/C2=CC3=C(C=C2)OCO3)N4CCCCC4=O

InChI

InChI=1S/C22H22N2O4/c1-15-5-8-17(13-18(15)24-11-3-2-4-22(24)26)23-21(25)10-7-16-6-9-19-20(12-16)28-14-27-19/h5-10,12-13H,2-4,11,14H2,1H3,(H,23,25)/b10-7+