(E)-3-(1,3-benzodioxol-5-yl)-N-[(2S)-heptan-2-yl]prop-2-enamide

Systemtic Name: (E)-3-(1,3-benzodioxol-5-yl)-N-[(2S)-heptan-2-yl]prop-2-enamide Openeye Name: (E)-3-(1,3-benzodioxol-5-yl)-N-[(1S)-1-methylhexyl]prop-2-enamide CAS Name: (E)-3-(1,3-benzodioxol-5-yl)-N-[(2S)-heptan-2-yl]-2-propenamide IUPAC Name: (E)-3-(1,3-benzodioxol-5-yl)-N-[(2S)-heptan-2-yl]prop-2-enamide Traditional Name: (E)-3-(1,3-benzodioxol-5-yl)-N-[(1S)-1-methylhexyl]acrylamide Formula: C17H23NO3 MolecularWeight: 289.36942

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)NC(=O)C=CC1=CC2=C(C=C1)OCO2

Isomeric SMILES

CCCCC[C@H](C)NC(=O)/C=C/C1=CC2=C(C=C1)OCO2

InChI

InChI=1S/C17H23NO3/c1-3-4-5-6-13(2)18-17(19)10-8-14-7-9-15-16(11-14)21-12-20-15/h7-11,13H,3-6,12H2,1-2H3,(H,18,19)/b10-8+/t13-/m0/s1