ethanedioic acid; [4-(phenylmethyl)piperazin-1-yl]-piperidin-4-yl-methanone

Systemtic Name: ethanedioic acid; [4-(phenylmethyl)piperazin-1-yl]-piperidin-4-yl-methanone Openeye Name: (4-benzylpiperazin-1-yl)-(4-piperidyl)methanone; oxalic acid CAS Name: oxalic acid; [4-(phenylmethyl)-1-piperazinyl]-(4-piperidinyl)methanone IUPAC Name: (4-benzylpiperazin-1-yl)-piperidin-4-ylmethanone; oxalic acid Traditional Name: (4-benzylpiperazino)-(4-piperidyl)methanone; oxalic acid Formula: C19H27N3O5 MolecularWeight: 377.43478

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCC1C(=O)N2CCN(CC2)CC3=CC=CC=C3.C(=O)(C(=O)O)O

Isomeric SMILES

C1CNCCC1C(=O)N2CCN(CC2)CC3=CC=CC=C3.C(=O)(C(=O)O)O

InChI

InChI=1S/C17H25N3O.C2H2O4/c21-17(16-6-8-18-9-7-16)20-12-10-19(11-13-20)14-15-4-2-1-3-5-15;3-1(4)2(5)6/h1-5,16,18H,6-14H2;(H,3,4)(H,5,6)