N-(2,4-dichlorophenyl)-2-(4-pyridin-2-ylpiperazin-1-yl)propanamide; ethanedioic acid

Systemtic Name: N-(2,4-dichlorophenyl)-2-(4-pyridin-2-ylpiperazin-1-yl)propanamide; ethanedioic acid Openeye Name: N-(2,4-dichlorophenyl)-2-[4-(2-pyridyl)piperazin-1-yl]propanamide; oxalic acid CAS Name: N-(2,4-dichlorophenyl)-2-[4-(2-pyridinyl)-1-piperazinyl]propanamide; oxalic acid IUPAC Name: N-(2,4-dichlorophenyl)-2-(4-pyridin-2-ylpiperazin-1-yl)propanamide; oxalic acid Traditional Name: N-(2,4-dichlorophenyl)-2-[4-(2-pyridyl)piperazino]propionamide; oxalic acid Formula: C20H22Cl2N4O5 MolecularWeight: 469.31848

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=C(C=C(C=C1)Cl)Cl)N2CCN(CC2)C3=CC=CC=N3.C(=O)(C(=O)O)O

Isomeric SMILES

CC(C(=O)NC1=C(C=C(C=C1)Cl)Cl)N2CCN(CC2)C3=CC=CC=N3.C(=O)(C(=O)O)O

InChI

InChI=1S/C18H20Cl2N4O.C2H2O4/c1-13(18(25)22-16-6-5-14(19)12-15(16)20)23-8-10-24(11-9-23)17-4-2-3-7-21-17;3-1(4)2(5)6/h2-7,12-13H,8-11H2,1H3,(H,22,25);(H,3,4)(H,5,6)