ethanedioic acid; N-[(3-methoxyphenyl)methyl]adamantan-1-amine

Systemtic Name: ethanedioic acid; N-[(3-methoxyphenyl)methyl]adamantan-1-amine Openeye Name: N-[(3-methoxyphenyl)methyl]adamantan-1-amine; oxalic acid CAS Name: N-[(3-methoxyphenyl)methyl]-1-adamantanamine; oxalic acid IUPAC Name: N-[(3-methoxyphenyl)methyl]adamantan-1-amine; oxalic acid Traditional Name: 1-adamantyl(m-anisyl)amine; oxalic acid Formula: C20H27NO5 MolecularWeight: 361.43208

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)CNC23CC4CC(C2)CC(C4)C3.C(=O)(C(=O)O)O

Isomeric SMILES

COC1=CC=CC(=C1)CNC23CC4CC(C2)CC(C4)C3.C(=O)(C(=O)O)O

InChI

InChI=1S/C18H25NO.C2H2O4/c1-20-17-4-2-3-13(8-17)12-19-18-9-14-5-15(10-18)7-16(6-14)11-18;3-1(4)2(5)6/h2-4,8,14-16,19H,5-7,9-12H2,1H3;(H,3,4)(H,5,6)