ethanedioic acid; methyl 4-[3-(3-methylpiperidin-1-yl)propoxy]benzoate

Systemtic Name: ethanedioic acid; methyl 4-[3-(3-methylpiperidin-1-yl)propoxy]benzoate Openeye Name: methyl 4-[3-(3-methyl-1-piperidyl)propoxy]benzoate; oxalic acid CAS Name: 4-[3-(3-methyl-1-piperidinyl)propoxy]benzoic acid methyl ester; oxalic acid IUPAC Name: methyl 4-[3-(3-methylpiperidin-1-yl)propoxy]benzoate; oxalic acid Traditional Name: 4-[3-(3-methylpiperidino)propoxy]benzoic acid methyl ester; oxalic acid Formula: C19H27NO7 MolecularWeight: 381.42018

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)CCCOC2=CC=C(C=C2)C(=O)OC.C(=O)(C(=O)O)O

Isomeric SMILES

CC1CCCN(C1)CCCOC2=CC=C(C=C2)C(=O)OC.C(=O)(C(=O)O)O

InChI

InChI=1S/C17H25NO3.C2H2O4/c1-14-5-3-10-18(13-14)11-4-12-21-16-8-6-15(7-9-16)17(19)20-2;3-1(4)2(5)6/h6-9,14H,3-5,10-13H2,1-2H3;(H,3,4)(H,5,6)