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

Systemtic Name: (E)-3-(1,3-benzodioxol-5-yl)-N-[(1S,2R)-2-methylcyclohexyl]prop-2-enamide Openeye Name: (E)-3-(1,3-benzodioxol-5-yl)-N-[(1S,2R)-2-methylcyclohexyl]prop-2-enamide CAS Name: (E)-3-(1,3-benzodioxol-5-yl)-N-[(1S,2R)-2-methylcyclohexyl]-2-propenamide IUPAC Name: (E)-3-(1,3-benzodioxol-5-yl)-N-[(1S,2R)-2-methylcyclohexyl]prop-2-enamide Traditional Name: (E)-3-(1,3-benzodioxol-5-yl)-N-[(1S,2R)-2-methylcyclohexyl]acrylamide Formula: C17H21NO3 MolecularWeight: 287.35354

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCC1NC(=O)C=CC2=CC3=C(C=C2)OCO3

Isomeric SMILES

C[C@@H]1CCCC[C@@H]1NC(=O)/C=C/C2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C17H21NO3/c1-12-4-2-3-5-14(12)18-17(19)9-7-13-6-8-15-16(10-13)21-11-20-15/h6-10,12,14H,2-5,11H2,1H3,(H,18,19)/b9-7+/t12-,14+/m1/s1