4-[1-(1,3-benzodioxol-5-yl)propan-2-yl-ethyl-amino]-1-(4-oxidanylpiperidin-1-yl)butan-1-one

Systemtic Name: 4-[1-(1,3-benzodioxol-5-yl)propan-2-yl-ethyl-amino]-1-(4-oxidanylpiperidin-1-yl)butan-1-one Openeye Name: 4-[[2-(1,3-benzodioxol-5-yl)-1-methyl-ethyl]-ethyl-amino]-1-(4-hydroxy-1-piperidyl)butan-1-one CAS Name: 4-[1-(1,3-benzodioxol-5-yl)propan-2-yl-ethylamino]-1-(4-hydroxy-1-piperidinyl)-1-butanone IUPAC Name: 4-[1-(1,3-benzodioxol-5-yl)propan-2-yl-ethylamino]-1-(4-hydroxypiperidin-1-yl)butan-1-one Traditional Name: 4-[[2-(1,3-benzodioxol-5-yl)-1-methyl-ethyl]-ethyl-amino]-1-(4-hydroxypiperidino)butan-1-one Formula: C21H32N2O4 MolecularWeight: 376.48978

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CCCC(=O)N1CCC(CC1)O)C(C)CC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CCN(CCCC(=O)N1CCC(CC1)O)C(C)CC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C21H32N2O4/c1-3-22(10-4-5-21(25)23-11-8-18(24)9-12-23)16(2)13-17-6-7-19-20(14-17)27-15-26-19/h6-7,14,16,18,24H,3-5,8-13,15H2,1-2H3