N-[(2,5-dimethoxyphenyl)methyl]cycloheptanamine; ethanedioic acid

Systemtic Name: N-[(2,5-dimethoxyphenyl)methyl]cycloheptanamine; ethanedioic acid Openeye Name: N-[(2,5-dimethoxyphenyl)methyl]cycloheptanamine; oxalic acid CAS Name: N-[(2,5-dimethoxyphenyl)methyl]cycloheptanamine; oxalic acid IUPAC Name: N-[(2,5-dimethoxyphenyl)methyl]cycloheptanamine; oxalic acid Traditional Name: cycloheptyl-(2,5-dimethoxybenzyl)amine; oxalic acid Formula: C18H27NO6 MolecularWeight: 353.41008

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)CNC2CCCCCC2.C(=O)(C(=O)O)O

Isomeric SMILES

COC1=CC(=C(C=C1)OC)CNC2CCCCCC2.C(=O)(C(=O)O)O

InChI

InChI=1S/C16H25NO2.C2H2O4/c1-18-15-9-10-16(19-2)13(11-15)12-17-14-7-5-3-4-6-8-14;3-1(4)2(5)6/h9-11,14,17H,3-8,12H2,1-2H3;(H,3,4)(H,5,6)