1-[(E)-1-(1,3-benzodioxol-5-yl)-3-oxidanylidene-3-(3,3,4-trimethyl-6-azabicyclo[3.2.1]octan-6-yl)prop-1-en-2-yl]piperidin-2-one

Systemtic Name: 1-[(E)-1-(1,3-benzodioxol-5-yl)-3-oxidanylidene-3-(3,3,4-trimethyl-6-azabicyclo[3.2.1]octan-6-yl)prop-1-en-2-yl]piperidin-2-one Openeye Name: 1-[(E)-2-(1,3-benzodioxol-5-yl)-1-(3,3,4-trimethyl-6-azabicyclo[3.2.1]octane-6-carbonyl)vinyl]piperidin-2-one CAS Name: 1-[(E)-1-(1,3-benzodioxol-5-yl)-3-oxo-3-(3,3,4-trimethyl-6-azabicyclo[3.2.1]octan-6-yl)prop-1-en-2-yl]-2-piperidinone IUPAC Name: 1-[(E)-1-(1,3-benzodioxol-5-yl)-3-oxo-3-(3,3,4-trimethyl-6-azabicyclo[3.2.1]octan-6-yl)prop-1-en-2-yl]piperidin-2-one Traditional Name: 1-[(E)-2-(1,3-benzodioxol-5-yl)-1-(3,3,4-trimethyl-6-azabicyclo[3.2.1]octane-6-carbonyl)vinyl]-2-piperidone Formula: C25H32N2O4 MolecularWeight: 424.53258

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Descriptors Computed from Structure

Canonical SMILES:

CC1C2CC(CC1(C)C)CN2C(=O)C(=CC3=CC4=C(C=C3)OCO4)N5CCCCC5=O

Isomeric SMILES

CC1C2CC(CC1(C)C)CN2C(=O)/C(=C\C3=CC4=C(C=C3)OCO4)/N5CCCCC5=O

InChI

InChI=1S/C25H32N2O4/c1-16-19-11-18(13-25(16,2)3)14-27(19)24(29)20(26-9-5-4-6-23(26)28)10-17-7-8-21-22(12-17)31-15-30-21/h7-8,10,12,16,18-19H,4-6,9,11,13-15H2,1-3H3/b20-10+