[(1R,4S,5R,6R)-6-(1,3-benzodioxol-5-yl)-4-pentyl-5-piperidin-1-ylcarbonyl-cyclohex-2-en-1-yl]-piperidin-1-yl-methanone

Systemtic Name: [(1R,4S,5R,6R)-6-(1,3-benzodioxol-5-yl)-4-pentyl-5-piperidin-1-ylcarbonyl-cyclohex-2-en-1-yl]-piperidin-1-yl-methanone Openeye Name: [(1R,4S,5R,6R)-6-(1,3-benzodioxol-5-yl)-4-pentyl-5-(piperidine-1-carbonyl)cyclohex-2-en-1-yl]-(1-piperidyl)methanone CAS Name: [(1R,4S,5R,6R)-6-(1,3-benzodioxol-5-yl)-5-[oxo(1-piperidinyl)methyl]-4-pentyl-1-cyclohex-2-enyl]-(1-piperidinyl)methanone IUPAC Name: [(1R,4S,5R,6R)-6-(1,3-benzodioxol-5-yl)-4-pentyl-5-(piperidine-1-carbonyl)cyclohex-2-en-1-yl]-piperidin-1-ylmethanone Traditional Name: [(1R,4S,5R,6R)-4-amyl-6-(1,3-benzodioxol-5-yl)-5-(piperidine-1-carbonyl)cyclohex-2-en-1-yl]-piperidino-methanone Formula: C30H42N2O4 MolecularWeight: 494.66548

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1C=CC(C(C1C(=O)N2CCCCC2)C3=CC4=C(C=C3)OCO4)C(=O)N5CCCCC5

Isomeric SMILES

CCCCC[C@H]1C=C[C@H]([C@H]([C@@H]1C(=O)N2CCCCC2)C3=CC4=C(C=C3)OCO4)C(=O)N5CCCCC5

InChI

InChI=1S/C30H42N2O4/c1-2-3-6-11-22-12-14-24(29(33)31-16-7-4-8-17-31)27(23-13-15-25-26(20-23)36-21-35-25)28(22)30(34)32-18-9-5-10-19-32/h12-15,20,22,24,27-28H,2-11,16-19,21H2,1H3/t22-,24+,27+,28+/m0/s1