ethanedioic acid; 1-(oxolan-2-yl)-N-[(4-phenylmethoxyphenyl)methyl]methanamine

Systemtic Name: ethanedioic acid; 1-(oxolan-2-yl)-N-[(4-phenylmethoxyphenyl)methyl]methanamine Openeye Name: N-[(4-benzyloxyphenyl)methyl]-1-tetrahydrofuran-2-yl-methanamine; oxalic acid CAS Name: oxalic acid; 1-(2-oxolanyl)-N-[(4-phenylmethoxyphenyl)methyl]methanamine IUPAC Name: oxalic acid; 1-(oxolan-2-yl)-N-[(4-phenylmethoxyphenyl)methyl]methanamine Traditional Name: (4-benzoxybenzyl)-(tetrahydrofurfuryl)amine; oxalic acid Formula: C21H25NO6 MolecularWeight: 387.4263

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CNCC2=CC=C(C=C2)OCC3=CC=CC=C3.C(=O)(C(=O)O)O

Isomeric SMILES

C1CC(OC1)CNCC2=CC=C(C=C2)OCC3=CC=CC=C3.C(=O)(C(=O)O)O

InChI

InChI=1S/C19H23NO2.C2H2O4/c1-2-5-17(6-3-1)15-22-18-10-8-16(9-11-18)13-20-14-19-7-4-12-21-19;3-1(4)2(5)6/h1-3,5-6,8-11,19-20H,4,7,12-15H2;(H,3,4)(H,5,6)