N-[(5-bromanylthiophen-2-yl)methyl]-2-(furan-2-yl)-2-pyrrolidin-1-yl-ethanamine; ethanedioic acid

Systemtic Name: N-[(5-bromanylthiophen-2-yl)methyl]-2-(furan-2-yl)-2-pyrrolidin-1-yl-ethanamine; ethanedioic acid Openeye Name: N-[(5-bromo-2-thienyl)methyl]-2-(2-furyl)-2-pyrrolidin-1-yl-ethanamine; oxalic acid CAS Name: N-[(5-bromo-2-thiophenyl)methyl]-2-(2-furanyl)-2-(1-pyrrolidinyl)ethanamine; oxalic acid IUPAC Name: N-[(5-bromothiophen-2-yl)methyl]-2-(furan-2-yl)-2-pyrrolidin-1-ylethanamine; oxalic acid Traditional Name: (5-bromo-2-thienyl)methyl-[2-(2-furyl)-2-pyrrolidino-ethyl]amine; oxalic acid Formula: C19H23BrN2O9S MolecularWeight: 535.36292

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(CNCC2=CC=C(S2)Br)C3=CC=CO3.C(=O)(C(=O)O)O.C(=O)(C(=O)O)O

Isomeric SMILES

C1CCN(C1)C(CNCC2=CC=C(S2)Br)C3=CC=CO3.C(=O)(C(=O)O)O.C(=O)(C(=O)O)O

InChI

InChI=1S/C15H19BrN2OS.2C2H2O4/c16-15-6-5-12(20-15)10-17-11-13(14-4-3-9-19-14)18-7-1-2-8-18;2*3-1(4)2(5)6/h3-6,9,13,17H,1-2,7-8,10-11H2;2*(H,3,4)(H,5,6)