ethanedioic acid; 1-(1,2,3,4-tetrahydronaphthalen-1-ylamino)-3-(thiophen-2-ylmethoxy)propan-2-ol

Systemtic Name: ethanedioic acid; 1-(1,2,3,4-tetrahydronaphthalen-1-ylamino)-3-(thiophen-2-ylmethoxy)propan-2-ol Openeye Name: oxalic acid; 1-(tetralin-1-ylamino)-3-(2-thienylmethoxy)propan-2-ol CAS Name: oxalic acid; 1-(1,2,3,4-tetrahydronaphthalen-1-ylamino)-3-(thiophen-2-ylmethoxy)-2-propanol IUPAC Name: oxalic acid; 1-(1,2,3,4-tetrahydronaphthalen-1-ylamino)-3-(thiophen-2-ylmethoxy)propan-2-ol Traditional Name: oxalic acid; 1-(tetralin-1-ylamino)-3-(2-thenyloxy)propan-2-ol Formula: C20H25NO6S MolecularWeight: 407.4806

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C2=CC=CC=C2C1)NCC(COCC3=CC=CS3)O.C(=O)(C(=O)O)O

Isomeric SMILES

C1CC(C2=CC=CC=C2C1)NCC(COCC3=CC=CS3)O.C(=O)(C(=O)O)O

InChI

InChI=1S/C18H23NO2S.C2H2O4/c20-15(12-21-13-16-7-4-10-22-16)11-19-18-9-3-6-14-5-1-2-8-17(14)18;3-1(4)2(5)6/h1-2,4-5,7-8,10,15,18-20H,3,6,9,11-13H2;(H,3,4)(H,5,6)