ethanedioic acid; (1-propoxy-3-pyrrolidin-1-yl-propan-2-yl) N-(3-pentoxyphenyl)carbamate

Systemtic Name: ethanedioic acid; (1-propoxy-3-pyrrolidin-1-yl-propan-2-yl) N-(3-pentoxyphenyl)carbamate Openeye Name: oxalic acid; [1-(propoxymethyl)-2-pyrrolidin-1-yl-ethyl] N-(3-pentoxyphenyl)carbamate CAS Name: oxalic acid; N-(3-pentoxyphenyl)carbamic acid [1-propoxy-3-(1-pyrrolidinyl)propan-2-yl] ester IUPAC Name: oxalic acid; (1-propoxy-3-pyrrolidin-1-ylpropan-2-yl) N-(3-pentoxyphenyl)carbamate Traditional Name: N-(3-amoxyphenyl)carbamic acid [1-(propoxymethyl)-2-pyrrolidino-ethyl] ester; oxalic acid Formula: C24H38N2O8 MolecularWeight: 482.56712

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=CC(=C1)NC(=O)OC(CN2CCCC2)COCCC.C(=O)(C(=O)O)O

Isomeric SMILES

CCCCCOC1=CC=CC(=C1)NC(=O)OC(CN2CCCC2)COCCC.C(=O)(C(=O)O)O

InChI

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