ethanedioic acid; [1-[(3-methoxy-4-phenylmethoxy-phenyl)methyl]piperidin-4-yl]-morpholin-4-yl-methanone

Systemtic Name: ethanedioic acid; [1-[(3-methoxy-4-phenylmethoxy-phenyl)methyl]piperidin-4-yl]-morpholin-4-yl-methanone Openeye Name: [1-[(4-benzyloxy-3-methoxy-phenyl)methyl]-4-piperidyl]-morpholino-methanone; oxalic acid CAS Name: [1-[(3-methoxy-4-phenylmethoxyphenyl)methyl]-4-piperidinyl]-(4-morpholinyl)methanone; oxalic acid IUPAC Name: [1-[(3-methoxy-4-phenylmethoxyphenyl)methyl]piperidin-4-yl]-morpholin-4-ylmethanone; oxalic acid Traditional Name: [1-(4-benzoxy-3-methoxy-benzyl)-4-piperidyl]-morpholino-methanone; oxalic acid Formula: C27H34N2O8 MolecularWeight: 514.56746

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)CN2CCC(CC2)C(=O)N3CCOCC3)OCC4=CC=CC=C4.C(=O)(C(=O)O)O

Isomeric SMILES

COC1=C(C=CC(=C1)CN2CCC(CC2)C(=O)N3CCOCC3)OCC4=CC=CC=C4.C(=O)(C(=O)O)O

InChI

InChI=1S/C25H32N2O4.C2H2O4/c1-29-24-17-21(7-8-23(24)31-19-20-5-3-2-4-6-20)18-26-11-9-22(10-12-26)25(28)27-13-15-30-16-14-27;3-1(4)2(5)6/h2-8,17,22H,9-16,18-19H2,1H3;(H,3,4)(H,5,6)