ethanedioic acid; 4-(4-methoxyphenyl)-N-(3-morpholin-4-ylpropyl)oxane-4-carboxamide

Systemtic Name: ethanedioic acid; 4-(4-methoxyphenyl)-N-(3-morpholin-4-ylpropyl)oxane-4-carboxamide Openeye Name: 4-(4-methoxyphenyl)-N-(3-morpholinopropyl)tetrahydropyran-4-carboxamide; oxalic acid CAS Name: 4-(4-methoxyphenyl)-N-[3-(4-morpholinyl)propyl]-4-oxanecarboxamide; oxalic acid IUPAC Name: 4-(4-methoxyphenyl)-N-(3-morpholin-4-ylpropyl)oxane-4-carboxamide; oxalic acid Traditional Name: 4-(4-methoxyphenyl)-N-(3-morpholinopropyl)tetrahydropyran-4-carboxamide; oxalic acid Formula: C22H32N2O8 MolecularWeight: 452.49808

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2(CCOCC2)C(=O)NCCCN3CCOCC3.C(=O)(C(=O)O)O

Isomeric SMILES

COC1=CC=C(C=C1)C2(CCOCC2)C(=O)NCCCN3CCOCC3.C(=O)(C(=O)O)O

InChI

InChI=1S/C20H30N2O4.C2H2O4/c1-24-18-5-3-17(4-6-18)20(7-13-25-14-8-20)19(23)21-9-2-10-22-11-15-26-16-12-22;3-1(4)2(5)6/h3-6H,2,7-16H2,1H3,(H,21,23);(H,3,4)(H,5,6)