ethanedioic acid; 1-[(3-methoxy-4-phenylmethoxy-phenyl)methyl]piperidine-4-carboxamide

Systemtic Name: ethanedioic acid; 1-[(3-methoxy-4-phenylmethoxy-phenyl)methyl]piperidine-4-carboxamide Openeye Name: 1-[(4-benzyloxy-3-methoxy-phenyl)methyl]piperidine-4-carboxamide; oxalic acid CAS Name: 1-[(3-methoxy-4-phenylmethoxyphenyl)methyl]-4-piperidinecarboxamide; oxalic acid IUPAC Name: 1-[(3-methoxy-4-phenylmethoxyphenyl)methyl]piperidine-4-carboxamide; oxalic acid Traditional Name: 1-(4-benzoxy-3-methoxy-benzyl)isonipecotamide; oxalic acid Formula: C23H28N2O7 MolecularWeight: 444.47762

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)CN2CCC(CC2)C(=O)N)OCC3=CC=CC=C3.C(=O)(C(=O)O)O

Isomeric SMILES

COC1=C(C=CC(=C1)CN2CCC(CC2)C(=O)N)OCC3=CC=CC=C3.C(=O)(C(=O)O)O

InChI

InChI=1S/C21H26N2O3.C2H2O4/c1-25-20-13-17(14-23-11-9-18(10-12-23)21(22)24)7-8-19(20)26-15-16-5-3-2-4-6-16;3-1(4)2(5)6/h2-8,13,18H,9-12,14-15H2,1H3,(H2,22,24);(H,3,4)(H,5,6)