ethanedioic acid; (4-phenylpiperazin-1-yl)-piperidin-4-yl-methanone

Systemtic Name: ethanedioic acid; (4-phenylpiperazin-1-yl)-piperidin-4-yl-methanone Openeye Name: oxalic acid; (4-phenylpiperazin-1-yl)-(4-piperidyl)methanone CAS Name: oxalic acid; (4-phenyl-1-piperazinyl)-(4-piperidinyl)methanone IUPAC Name: oxalic acid; (4-phenylpiperazin-1-yl)-piperidin-4-ylmethanone Traditional Name: oxalic acid; (4-phenylpiperazino)-(4-piperidyl)methanone Formula: C18H25N3O5 MolecularWeight: 363.4082

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CNCCC1C(=O)N2CCN(CC2)C3=CC=CC=C3.C(=O)(C(=O)O)O

Isomeric SMILES

C1CNCCC1C(=O)N2CCN(CC2)C3=CC=CC=C3.C(=O)(C(=O)O)O

InChI

InChI=1S/C16H23N3O.C2H2O4/c20-16(14-6-8-17-9-7-14)19-12-10-18(11-13-19)15-4-2-1-3-5-15;3-1(4)2(5)6/h1-5,14,17H,6-13H2;(H,3,4)(H,5,6)