1-(4-cyclohexylpiperazin-1-yl)-2-phenyl-ethanone; ethanedioic acid

Systemtic Name: 1-(4-cyclohexylpiperazin-1-yl)-2-phenyl-ethanone; ethanedioic acid Openeye Name: 1-(4-cyclohexylpiperazin-1-yl)-2-phenyl-ethanone; oxalic acid CAS Name: 1-(4-cyclohexyl-1-piperazinyl)-2-phenylethanone; oxalic acid IUPAC Name: 1-(4-cyclohexylpiperazin-1-yl)-2-phenylethanone; oxalic acid Traditional Name: 1-(4-cyclohexylpiperazino)-2-phenyl-ethanone; oxalic acid Formula: C20H28N2O5 MolecularWeight: 376.44672

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2CCN(CC2)C(=O)CC3=CC=CC=C3.C(=O)(C(=O)O)O

Isomeric SMILES

C1CCC(CC1)N2CCN(CC2)C(=O)CC3=CC=CC=C3.C(=O)(C(=O)O)O

InChI

InChI=1S/C18H26N2O.C2H2O4/c21-18(15-16-7-3-1-4-8-16)20-13-11-19(12-14-20)17-9-5-2-6-10-17;3-1(4)2(5)6/h1,3-4,7-8,17H,2,5-6,9-15H2;(H,3,4)(H,5,6)