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

Systemtic Name: (4-cyclohexylpiperazin-1-yl)-(4-phenylphenyl)methanone; ethanedioic acid Openeye Name: (4-cyclohexylpiperazin-1-yl)-(4-phenylphenyl)methanone; oxalic acid CAS Name: (4-cyclohexyl-1-piperazinyl)-(4-phenylphenyl)methanone; oxalic acid IUPAC Name: (4-cyclohexylpiperazin-1-yl)-(4-phenylphenyl)methanone; oxalic acid Traditional Name: (4-cyclohexylpiperazino)-(4-phenylphenyl)methanone; oxalic acid Formula: C25H30N2O5 MolecularWeight: 438.5161

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2CCN(CC2)C(=O)C3=CC=C(C=C3)C4=CC=CC=C4.C(=O)(C(=O)O)O

Isomeric SMILES

C1CCC(CC1)N2CCN(CC2)C(=O)C3=CC=C(C=C3)C4=CC=CC=C4.C(=O)(C(=O)O)O

InChI

InChI=1S/C23H28N2O.C2H2O4/c26-23(21-13-11-20(12-14-21)19-7-3-1-4-8-19)25-17-15-24(16-18-25)22-9-5-2-6-10-22;3-1(4)2(5)6/h1,3-4,7-8,11-14,22H,2,5-6,9-10,15-18H2;(H,3,4)(H,5,6)