2-(1-adamantyl)-N-[(4-methoxyphenyl)methyl]ethanamine; ethanedioic acid

Systemtic Name: 2-(1-adamantyl)-N-[(4-methoxyphenyl)methyl]ethanamine; ethanedioic acid Openeye Name: 2-(1-adamantyl)-N-[(4-methoxyphenyl)methyl]ethanamine; oxalic acid CAS Name: 2-(1-adamantyl)-N-[(4-methoxyphenyl)methyl]ethanamine; oxalic acid IUPAC Name: 2-(1-adamantyl)-N-[(4-methoxyphenyl)methyl]ethanamine; oxalic acid Traditional Name: 2-(1-adamantyl)ethyl-p-anisyl-amine; oxalic acid Formula: C22H31NO5 MolecularWeight: 389.48524

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CNCCC23CC4CC(C2)CC(C4)C3.C(=O)(C(=O)O)O

Isomeric SMILES

COC1=CC=C(C=C1)CNCCC23CC4CC(C2)CC(C4)C3.C(=O)(C(=O)O)O

InChI

InChI=1S/C20H29NO.C2H2O4/c1-22-19-4-2-15(3-5-19)14-21-7-6-20-11-16-8-17(12-20)10-18(9-16)13-20;3-1(4)2(5)6/h2-5,16-18,21H,6-14H2,1H3;(H,3,4)(H,5,6)