1-[2,4-bis(chloranyl)phenoxy]-3-(4-phenylpiperazin-1-yl)propan-2-ol; ethanedioic acid

Systemtic Name: 1-[2,4-bis(chloranyl)phenoxy]-3-(4-phenylpiperazin-1-yl)propan-2-ol; ethanedioic acid Openeye Name: 1-(2,4-dichlorophenoxy)-3-(4-phenylpiperazin-1-yl)propan-2-ol; oxalic acid CAS Name: 1-(2,4-dichlorophenoxy)-3-(4-phenyl-1-piperazinyl)-2-propanol; oxalic acid IUPAC Name: 1-(2,4-dichlorophenoxy)-3-(4-phenylpiperazin-1-yl)propan-2-ol; oxalic acid Traditional Name: 1-(2,4-dichlorophenoxy)-3-(4-phenylpiperazino)propan-2-ol; oxalic acid Formula: C21H24Cl2N2O6 MolecularWeight: 471.33106

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC(COC2=C(C=C(C=C2)Cl)Cl)O)C3=CC=CC=C3.C(=O)(C(=O)O)O

Isomeric SMILES

C1CN(CCN1CC(COC2=C(C=C(C=C2)Cl)Cl)O)C3=CC=CC=C3.C(=O)(C(=O)O)O

InChI

InChI=1S/C19H22Cl2N2O2.C2H2O4/c20-15-6-7-19(18(21)12-15)25-14-17(24)13-22-8-10-23(11-9-22)16-4-2-1-3-5-16;3-1(4)2(5)6/h1-7,12,17,24H,8-11,13-14H2;(H,3,4)(H,5,6)