2-[3-(azepan-1-ylmethyl)piperidin-1-yl]-3-thiophen-2-yl-propane-1,1,3-triol

Systemtic Name: 2-[3-(azepan-1-ylmethyl)piperidin-1-yl]-3-thiophen-2-yl-propane-1,1,3-triol Openeye Name: 2-[3-(azepan-1-ylmethyl)-1-piperidyl]-3-(2-thienyl)propane-1,1,3-triol CAS Name: 2-[3-(1-azepanylmethyl)-1-piperidinyl]-3-thiophen-2-ylpropane-1,1,3-triol IUPAC Name: 2-[3-(azepan-1-ylmethyl)piperidin-1-yl]-3-thiophen-2-ylpropane-1,1,3-triol Traditional Name: 2-[3-(azepan-1-ylmethyl)piperidino]-3-(2-thienyl)propane-1,1,3-triol Formula: C19H32N2O3S MolecularWeight: 368.53398

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)CC2CCCN(C2)C(C(C3=CC=CS3)O)C(O)O

Isomeric SMILES

C1CCCN(CC1)CC2CCCN(C2)C(C(C3=CC=CS3)O)C(O)O

InChI

InChI=1S/C19H32N2O3S/c22-18(16-8-6-12-25-16)17(19(23)24)21-11-5-7-15(14-21)13-20-9-3-1-2-4-10-20/h6,8,12,15,17-19,22-24H,1-5,7,9-11,13-14H2