ethanedioic acid; (1-piperidin-1-yl-3-propoxy-propan-2-yl) N-(3-butoxyphenyl)carbamate

Systemtic Name: ethanedioic acid; (1-piperidin-1-yl-3-propoxy-propan-2-yl) N-(3-butoxyphenyl)carbamate Openeye Name: oxalic acid; [1-(1-piperidylmethyl)-2-propoxy-ethyl] N-(3-butoxyphenyl)carbamate CAS Name: N-(3-butoxyphenyl)carbamic acid [1-(1-piperidinyl)-3-propoxypropan-2-yl] ester; oxalic acid IUPAC Name: oxalic acid; (1-piperidin-1-yl-3-propoxypropan-2-yl) N-(3-butoxyphenyl)carbamate Traditional Name: N-(3-butoxyphenyl)carbamic acid [1-(piperidinomethyl)-2-propoxy-ethyl] ester; oxalic acid Formula: C24H38N2O8 MolecularWeight: 482.56712

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=CC(=C1)NC(=O)OC(CN2CCCCC2)COCCC.C(=O)(C(=O)O)O

Isomeric SMILES

CCCCOC1=CC=CC(=C1)NC(=O)OC(CN2CCCCC2)COCCC.C(=O)(C(=O)O)O

InChI

InChI=1S/C22H36N2O4.C2H2O4/c1-3-5-15-27-20-11-9-10-19(16-20)23-22(25)28-21(18-26-14-4-2)17-24-12-7-6-8-13-24;3-1(4)2(5)6/h9-11,16,21H,3-8,12-15,17-18H2,1-2H3,(H,23,25);(H,3,4)(H,5,6)