ethanedioic acid; [2-[[methyl(octyl)amino]methyl]pyridin-3-yl] N,N-dimethylcarbamate

Systemtic Name: ethanedioic acid; [2-[[methyl(octyl)amino]methyl]pyridin-3-yl] N,N-dimethylcarbamate Openeye Name: [2-[[methyl(octyl)amino]methyl]-3-pyridyl] N,N-dimethylcarbamate; oxalic acid CAS Name: N,N-dimethylcarbamic acid [2-[[methyl(octyl)amino]methyl]-3-pyridinyl] ester; oxalic acid IUPAC Name: [2-[[methyl(octyl)amino]methyl]pyridin-3-yl] N,N-dimethylcarbamate; oxalic acid Traditional Name: N,N-dimethylcarbamic acid [2-[[methyl(octyl)amino]methyl]-3-pyridyl] ester; oxalic acid Formula: C20H33N3O6 MolecularWeight: 411.49252

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCN(C)CC1=C(C=CC=N1)OC(=O)N(C)C.C(=O)(C(=O)O)O

Isomeric SMILES

CCCCCCCCN(C)CC1=C(C=CC=N1)OC(=O)N(C)C.C(=O)(C(=O)O)O

InChI

InChI=1S/C18H31N3O2.C2H2O4/c1-5-6-7-8-9-10-14-21(4)15-16-17(12-11-13-19-16)23-18(22)20(2)3;3-1(4)2(5)6/h11-13H,5-10,14-15H2,1-4H3;(H,3,4)(H,5,6)