(3S)-3-(1-benzothiophen-7-yloxy)-N-methyl-3-thiophen-2-yl-propan-1-amine; ethanedioic acid

Systemtic Name: (3S)-3-(1-benzothiophen-7-yloxy)-N-methyl-3-thiophen-2-yl-propan-1-amine; ethanedioic acid Openeye Name: (3S)-3-(benzothiophen-7-yloxy)-N-methyl-3-(2-thienyl)propan-1-amine; oxalic acid CAS Name: (3S)-3-(1-benzothiophen-7-yloxy)-N-methyl-3-thiophen-2-yl-1-propanamine; oxalic acid IUPAC Name: (3S)-3-(1-benzothiophen-7-yloxy)-N-methyl-3-thiophen-2-ylpropan-1-amine; oxalic acid Traditional Name: [(3S)-3-(benzothiophen-7-yloxy)-3-(2-thienyl)propyl]-methyl-amine; oxalic acid Formula: C18H19NO5S2 MolecularWeight: 393.47716

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Descriptors Computed from Structure

Canonical SMILES:

CNCCC(C1=CC=CS1)OC2=CC=CC3=C2SC=C3.C(=O)(C(=O)O)O

Isomeric SMILES

CNCC[C@@H](C1=CC=CS1)OC2=CC=CC3=C2SC=C3.C(=O)(C(=O)O)O

InChI

InChI=1S/C16H17NOS2.C2H2O4/c1-17-9-7-13(15-6-3-10-19-15)18-14-5-2-4-12-8-11-20-16(12)14;3-1(4)2(5)6/h2-6,8,10-11,13,17H,7,9H2,1H3;(H,3,4)(H,5,6)/t13-;/m0./s1