ethanedioic acid; (1S)-3-[methyl-(phenylmethyl)amino]-1-thiophen-2-yl-propan-1-ol

Systemtic Name: ethanedioic acid; (1S)-3-[methyl-(phenylmethyl)amino]-1-thiophen-2-yl-propan-1-ol Openeye Name: (1S)-3-[benzyl(methyl)amino]-1-(2-thienyl)propan-1-ol; oxalic acid CAS Name: (1S)-3-[methyl-(phenylmethyl)amino]-1-thiophen-2-yl-1-propanol; oxalic acid IUPAC Name: (1S)-3-[benzyl(methyl)amino]-1-thiophen-2-ylpropan-1-ol; oxalic acid Traditional Name: (1S)-3-[benzyl(methyl)amino]-1-(2-thienyl)propan-1-ol; oxalic acid Formula: C17H21NO5S MolecularWeight: 351.41734

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC(C1=CC=CS1)O)CC2=CC=CC=C2.C(=O)(C(=O)O)O

Isomeric SMILES

CN(CC[C@@H](C1=CC=CS1)O)CC2=CC=CC=C2.C(=O)(C(=O)O)O

InChI

InChI=1S/C15H19NOS.C2H2O4/c1-16(12-13-6-3-2-4-7-13)10-9-14(17)15-8-5-11-18-15;3-1(4)2(5)6/h2-8,11,14,17H,9-10,12H2,1H3;(H,3,4)(H,5,6)/t14-;/m0./s1