2-[4-[[4-[4-[2-[4-(1,3-benzodioxol-5-ylsulfonyl)phenyl]-1,3-dioxolan-2-yl]piperidin-1-yl]piperidin-1-yl]methyl]phenoxy]-N,N-diethyl-ethanamine

Systemtic Name: 2-[4-[[4-[4-[2-[4-(1,3-benzodioxol-5-ylsulfonyl)phenyl]-1,3-dioxolan-2-yl]piperidin-1-yl]piperidin-1-yl]methyl]phenoxy]-N,N-diethyl-ethanamine Openeye Name: 2-[4-[[4-[4-[2-[4-(1,3-benzodioxol-5-ylsulfonyl)phenyl]-1,3-dioxolan-2-yl]-1-piperidyl]-1-piperidyl]methyl]phenoxy]-N,N-diethyl-ethanamine CAS Name: 2-[4-[[4-[4-[2-[4-(1,3-benzodioxol-5-ylsulfonyl)phenyl]-1,3-dioxolan-2-yl]-1-piperidinyl]-1-piperidinyl]methyl]phenoxy]-N,N-diethylethanamine IUPAC Name: 2-[4-[[4-[4-[2-[4-(1,3-benzodioxol-5-ylsulfonyl)phenyl]-1,3-dioxolan-2-yl]piperidin-1-yl]piperidin-1-yl]methyl]phenoxy]-N,N-diethylethanamine Traditional Name: 2-[4-[[4-[4-[2-[4-(1,3-benzodioxol-5-ylsulfonyl)phenyl]-1,3-dioxolan-2-yl]piperidino]piperidino]methyl]phenoxy]ethyl-diethyl-amine Formula: C39H51N3O7S MolecularWeight: 705.90314

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCOC1=CC=C(C=C1)CN2CCC(CC2)N3CCC(CC3)C4(OCCO4)C5=CC=C(C=C5)S(=O)(=O)C6=CC7=C(C=C6)OCO7

Isomeric SMILES

CCN(CC)CCOC1=CC=C(C=C1)CN2CCC(CC2)N3CCC(CC3)C4(OCCO4)C5=CC=C(C=C5)S(=O)(=O)C6=CC7=C(C=C6)OCO7

InChI

InChI=1S/C39H51N3O7S/c1-3-40(4-2)23-24-45-34-9-5-30(6-10-34)28-41-19-17-33(18-20-41)42-21-15-32(16-22-42)39(48-25-26-49-39)31-7-11-35(12-8-31)50(43,44)36-13-14-37-38(27-36)47-29-46-37/h5-14,27,32-33H,3-4,15-26,28-29H2,1-2H3