ethanedioic acid; 1-[(1-piperidin-1-ylcyclohexyl)methylamino]-3-(thiophen-2-ylmethoxy)propan-2-ol

Systemtic Name: ethanedioic acid; 1-[(1-piperidin-1-ylcyclohexyl)methylamino]-3-(thiophen-2-ylmethoxy)propan-2-ol Openeye Name: oxalic acid; 1-[[1-(1-piperidyl)cyclohexyl]methylamino]-3-(2-thienylmethoxy)propan-2-ol CAS Name: oxalic acid; 1-[[1-(1-piperidinyl)cyclohexyl]methylamino]-3-(thiophen-2-ylmethoxy)-2-propanol IUPAC Name: oxalic acid; 1-[(1-piperidin-1-ylcyclohexyl)methylamino]-3-(thiophen-2-ylmethoxy)propan-2-ol Traditional Name: oxalic acid; 1-[(1-piperidinocyclohexyl)methylamino]-3-(2-thenyloxy)propan-2-ol Formula: C24H38N2O10S MolecularWeight: 546.63092

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)(CNCC(COCC2=CC=CS2)O)N3CCCCC3.C(=O)(C(=O)O)O.C(=O)(C(=O)O)O

Isomeric SMILES

C1CCC(CC1)(CNCC(COCC2=CC=CS2)O)N3CCCCC3.C(=O)(C(=O)O)O.C(=O)(C(=O)O)O

InChI

InChI=1S/C20H34N2O2S.2C2H2O4/c23-18(15-24-16-19-8-7-13-25-19)14-21-17-20(9-3-1-4-10-20)22-11-5-2-6-12-22;2*3-1(4)2(5)6/h7-8,13,18,21,23H,1-6,9-12,14-17H2;2*(H,3,4)(H,5,6)