1-[(2-chlorophenyl)methoxy]-3-(4-propylpiperazin-1-yl)propan-2-ol; ethanedioic acid

Systemtic Name: 1-[(2-chlorophenyl)methoxy]-3-(4-propylpiperazin-1-yl)propan-2-ol; ethanedioic acid Openeye Name: 1-[(2-chlorophenyl)methoxy]-3-(4-propylpiperazin-1-yl)propan-2-ol; oxalic acid CAS Name: 1-[(2-chlorophenyl)methoxy]-3-(4-propyl-1-piperazinyl)-2-propanol; oxalic acid IUPAC Name: 1-[(2-chlorophenyl)methoxy]-3-(4-propylpiperazin-1-yl)propan-2-ol; oxalic acid Traditional Name: 1-(2-chlorobenzyl)oxy-3-(4-propylpiperazino)propan-2-ol; oxalic acid Formula: C21H31ClN2O10 MolecularWeight: 506.93124

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN1CCN(CC1)CC(COCC2=CC=CC=C2Cl)O.C(=O)(C(=O)O)O.C(=O)(C(=O)O)O

Isomeric SMILES

CCCN1CCN(CC1)CC(COCC2=CC=CC=C2Cl)O.C(=O)(C(=O)O)O.C(=O)(C(=O)O)O

InChI

InChI=1S/C17H27ClN2O2.2C2H2O4/c1-2-7-19-8-10-20(11-9-19)12-16(21)14-22-13-15-5-3-4-6-17(15)18;2*3-1(4)2(5)6/h3-6,16,21H,2,7-14H2,1H3;2*(H,3,4)(H,5,6)