ethanedioic acid; methyl 3-[[2-(furan-2-yl)-2-piperidin-1-yl-ethyl]amino]propanoate

Systemtic Name: ethanedioic acid; methyl 3-[[2-(furan-2-yl)-2-piperidin-1-yl-ethyl]amino]propanoate Openeye Name: methyl 3-[[2-(2-furyl)-2-(1-piperidyl)ethyl]amino]propanoate; oxalic acid CAS Name: 3-[[2-(2-furanyl)-2-(1-piperidinyl)ethyl]amino]propanoic acid methyl ester; oxalic acid IUPAC Name: methyl 3-[[2-(furan-2-yl)-2-piperidin-1-ylethyl]amino]propanoate; oxalic acid Traditional Name: 3-[[2-(2-furyl)-2-piperidino-ethyl]amino]propionic acid methyl ester; oxalic acid Formula: C17H26N2O7 MolecularWeight: 370.39754

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCNCC(C1=CC=CO1)N2CCCCC2.C(=O)(C(=O)O)O

Isomeric SMILES

COC(=O)CCNCC(C1=CC=CO1)N2CCCCC2.C(=O)(C(=O)O)O

InChI

InChI=1S/C15H24N2O3.C2H2O4/c1-19-15(18)7-8-16-12-13(14-6-5-11-20-14)17-9-3-2-4-10-17;3-1(4)2(5)6/h5-6,11,13,16H,2-4,7-10,12H2,1H3;(H,3,4)(H,5,6)