ethanedioic acid; 2-[[2-(furan-2-yl)-2-piperidin-1-yl-ethyl]amino]-1-phenyl-ethanol

Systemtic Name: ethanedioic acid; 2-[[2-(furan-2-yl)-2-piperidin-1-yl-ethyl]amino]-1-phenyl-ethanol Openeye Name: 2-[[2-(2-furyl)-2-(1-piperidyl)ethyl]amino]-1-phenyl-ethanol; oxalic acid CAS Name: 2-[[2-(2-furanyl)-2-(1-piperidinyl)ethyl]amino]-1-phenylethanol; oxalic acid IUPAC Name: 2-[[2-(furan-2-yl)-2-piperidin-1-ylethyl]amino]-1-phenylethanol; oxalic acid Traditional Name: 2-[[2-(2-furyl)-2-piperidino-ethyl]amino]-1-phenyl-ethanol; oxalic acid Formula: C21H28N2O6 MolecularWeight: 404.45682

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(CNCC(C2=CC=CC=C2)O)C3=CC=CO3.C(=O)(C(=O)O)O

Isomeric SMILES

C1CCN(CC1)C(CNCC(C2=CC=CC=C2)O)C3=CC=CO3.C(=O)(C(=O)O)O

InChI

InChI=1S/C19H26N2O2.C2H2O4/c22-18(16-8-3-1-4-9-16)15-20-14-17(19-10-7-13-23-19)21-11-5-2-6-12-21;3-1(4)2(5)6/h1,3-4,7-10,13,17-18,20,22H,2,5-6,11-12,14-15H2;(H,3,4)(H,5,6)