ethanedioic acid; 1-[(3-methoxy-4-phenylmethoxy-phenyl)methyl-methyl-amino]-3-morpholin-4-yl-propan-2-ol

Systemtic Name: ethanedioic acid; 1-[(3-methoxy-4-phenylmethoxy-phenyl)methyl-methyl-amino]-3-morpholin-4-yl-propan-2-ol Openeye Name: 1-[(4-benzyloxy-3-methoxy-phenyl)methyl-methyl-amino]-3-morpholino-propan-2-ol; oxalic acid CAS Name: 1-[(3-methoxy-4-phenylmethoxyphenyl)methyl-methylamino]-3-(4-morpholinyl)-2-propanol; oxalic acid IUPAC Name: 1-[(3-methoxy-4-phenylmethoxyphenyl)methyl-methylamino]-3-morpholin-4-ylpropan-2-ol; oxalic acid Traditional Name: 1-[(4-benzoxy-3-methoxy-benzyl)-methyl-amino]-3-morpholino-propan-2-ol; oxalic acid Formula: C27H36N2O12 MolecularWeight: 580.58094

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC(=C(C=C1)OCC2=CC=CC=C2)OC)CC(CN3CCOCC3)O.C(=O)(C(=O)O)O.C(=O)(C(=O)O)O

Isomeric SMILES

CN(CC1=CC(=C(C=C1)OCC2=CC=CC=C2)OC)CC(CN3CCOCC3)O.C(=O)(C(=O)O)O.C(=O)(C(=O)O)O

InChI

InChI=1S/C23H32N2O4.2C2H2O4/c1-24(16-21(26)17-25-10-12-28-13-11-25)15-20-8-9-22(23(14-20)27-2)29-18-19-6-4-3-5-7-19;2*3-1(4)2(5)6/h3-9,14,21,26H,10-13,15-18H2,1-2H3;2*(H,3,4)(H,5,6)