2,6-dimethoxy-4-[(4-pentan-3-ylpiperazin-1-yl)methyl]phenol; ethanedioic acid

Systemtic Name: 2,6-dimethoxy-4-[(4-pentan-3-ylpiperazin-1-yl)methyl]phenol; ethanedioic acid Openeye Name: 4-[[4-(1-ethylpropyl)piperazin-1-yl]methyl]-2,6-dimethoxy-phenol; oxalic acid CAS Name: 2,6-dimethoxy-4-[(4-pentan-3-yl-1-piperazinyl)methyl]phenol; oxalic acid IUPAC Name: 2,6-dimethoxy-4-[(4-pentan-3-ylpiperazin-1-yl)methyl]phenol; oxalic acid Traditional Name: 4-[[4-(1-ethylpropyl)piperazino]methyl]-2,6-dimethoxy-phenol; oxalic acid Formula: C20H32N2O7 MolecularWeight: 412.47728

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)N1CCN(CC1)CC2=CC(=C(C(=C2)OC)O)OC.C(=O)(C(=O)O)O

Isomeric SMILES

CCC(CC)N1CCN(CC1)CC2=CC(=C(C(=C2)OC)O)OC.C(=O)(C(=O)O)O

InChI

InChI=1S/C18H30N2O3.C2H2O4/c1-5-15(6-2)20-9-7-19(8-10-20)13-14-11-16(22-3)18(21)17(12-14)23-4;3-1(4)2(5)6/h11-12,15,21H,5-10,13H2,1-4H3;(H,3,4)(H,5,6)