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

Systemtic Name: [1-(cyclohexylmethyl)piperidin-4-yl]-(4-phenylpiperazin-1-yl)methanone; ethanedioic acid Openeye Name: [1-(cyclohexylmethyl)-4-piperidyl]-(4-phenylpiperazin-1-yl)methanone; oxalic acid CAS Name: [1-(cyclohexylmethyl)-4-piperidinyl]-(4-phenyl-1-piperazinyl)methanone; oxalic acid IUPAC Name: [1-(cyclohexylmethyl)piperidin-4-yl]-(4-phenylpiperazin-1-yl)methanone; oxalic acid Traditional Name: [1-(cyclohexylmethyl)-4-piperidyl]-(4-phenylpiperazino)methanone; oxalic acid Formula: C25H37N3O5 MolecularWeight: 459.57838

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CN2CCC(CC2)C(=O)N3CCN(CC3)C4=CC=CC=C4.C(=O)(C(=O)O)O

Isomeric SMILES

C1CCC(CC1)CN2CCC(CC2)C(=O)N3CCN(CC3)C4=CC=CC=C4.C(=O)(C(=O)O)O

InChI

InChI=1S/C23H35N3O.C2H2O4/c27-23(26-17-15-25(16-18-26)22-9-5-2-6-10-22)21-11-13-24(14-12-21)19-20-7-3-1-4-8-20;3-1(4)2(5)6/h2,5-6,9-10,20-21H,1,3-4,7-8,11-19H2;(H,3,4)(H,5,6)