ethanedioic acid; 1-[2-[4-(2-oxidanyl-3-phenylmethoxy-propyl)piperazin-1-yl]ethylamino]-3-phenylmethoxy-propan-2-ol

Systemtic Name: ethanedioic acid; 1-[2-[4-(2-oxidanyl-3-phenylmethoxy-propyl)piperazin-1-yl]ethylamino]-3-phenylmethoxy-propan-2-ol Openeye Name: 1-benzyloxy-3-[2-[4-(3-benzyloxy-2-hydroxy-propyl)piperazin-1-yl]ethylamino]propan-2-ol; oxalic acid CAS Name: 1-[2-[4-(2-hydroxy-3-phenylmethoxypropyl)-1-piperazinyl]ethylamino]-3-phenylmethoxy-2-propanol; oxalic acid IUPAC Name: 1-[2-[4-(2-hydroxy-3-phenylmethoxypropyl)piperazin-1-yl]ethylamino]-3-phenylmethoxypropan-2-ol; oxalic acid Traditional Name: 1-benzoxy-3-[2-[4-(3-benzoxy-2-hydroxy-propyl)piperazino]ethylamino]propan-2-ol; oxalic acid Formula: C28H41N3O8 MolecularWeight: 547.64044

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCNCC(COCC2=CC=CC=C2)O)CC(COCC3=CC=CC=C3)O.C(=O)(C(=O)O)O

Isomeric SMILES

C1CN(CCN1CCNCC(COCC2=CC=CC=C2)O)CC(COCC3=CC=CC=C3)O.C(=O)(C(=O)O)O

InChI

InChI=1S/C26H39N3O4.C2H2O4/c30-25(21-32-19-23-7-3-1-4-8-23)17-27-11-12-28-13-15-29(16-14-28)18-26(31)22-33-20-24-9-5-2-6-10-24;3-1(4)2(5)6/h1-10,25-27,30-31H,11-22H2;(H,3,4)(H,5,6)