4-[(cycloheptylamino)methyl]-2,6-dimethoxy-phenol; ethanedioic acid

Systemtic Name: 4-[(cycloheptylamino)methyl]-2,6-dimethoxy-phenol; ethanedioic acid Openeye Name: 4-[(cycloheptylamino)methyl]-2,6-dimethoxy-phenol; oxalic acid CAS Name: 4-[(cycloheptylamino)methyl]-2,6-dimethoxyphenol; oxalic acid IUPAC Name: 4-[(cycloheptylamino)methyl]-2,6-dimethoxyphenol; oxalic acid Traditional Name: 4-[(cycloheptylamino)methyl]-2,6-dimethoxy-phenol; oxalic acid Formula: C18H27NO7 MolecularWeight: 369.40948

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1O)OC)CNC2CCCCCC2.C(=O)(C(=O)O)O

Isomeric SMILES

COC1=CC(=CC(=C1O)OC)CNC2CCCCCC2.C(=O)(C(=O)O)O

InChI

InChI=1S/C16H25NO3.C2H2O4/c1-19-14-9-12(10-15(20-2)16(14)18)11-17-13-7-5-3-4-6-8-13;3-1(4)2(5)6/h9-10,13,17-18H,3-8,11H2,1-2H3;(H,3,4)(H,5,6)