(4-cyclohexylpiperazin-1-yl)-pyridin-4-yl-methanone; ethanedioic acid

Systemtic Name: (4-cyclohexylpiperazin-1-yl)-pyridin-4-yl-methanone; ethanedioic acid Openeye Name: (4-cyclohexylpiperazin-1-yl)-(4-pyridyl)methanone; oxalic acid CAS Name: (4-cyclohexyl-1-piperazinyl)-pyridin-4-ylmethanone; oxalic acid IUPAC Name: (4-cyclohexylpiperazin-1-yl)-pyridin-4-ylmethanone; oxalic acid Traditional Name: (4-cyclohexylpiperazino)-(4-pyridyl)methanone; oxalic acid Formula: C18H25N3O5 MolecularWeight: 363.4082

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2CCN(CC2)C(=O)C3=CC=NC=C3.C(=O)(C(=O)O)O

Isomeric SMILES

C1CCC(CC1)N2CCN(CC2)C(=O)C3=CC=NC=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/h6-9,15H,1-5,10-13H2;(H,3,4)(H,5,6)