3-cyclopentyl-1-[4-(4-phenylpiperazin-1-yl)piperidin-1-yl]propan-1-one; ethanedioic acid

Systemtic Name: 3-cyclopentyl-1-[4-(4-phenylpiperazin-1-yl)piperidin-1-yl]propan-1-one; ethanedioic acid Openeye Name: 3-cyclopentyl-1-[4-(4-phenylpiperazin-1-yl)-1-piperidyl]propan-1-one; oxalic acid CAS Name: 3-cyclopentyl-1-[4-(4-phenyl-1-piperazinyl)-1-piperidinyl]-1-propanone; oxalic acid IUPAC Name: 3-cyclopentyl-1-[4-(4-phenylpiperazin-1-yl)piperidin-1-yl]propan-1-one; oxalic acid Traditional Name: 3-cyclopentyl-1-[4-(4-phenylpiperazino)piperidino]propan-1-one; oxalic acid Formula: C25H37N3O5 MolecularWeight: 459.57838

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)CCC(=O)N2CCC(CC2)N3CCN(CC3)C4=CC=CC=C4.C(=O)(C(=O)O)O

Isomeric SMILES

C1CCC(C1)CCC(=O)N2CCC(CC2)N3CCN(CC3)C4=CC=CC=C4.C(=O)(C(=O)O)O

InChI

InChI=1S/C23H35N3O.C2H2O4/c27-23(11-10-20-6-4-5-7-20)26-14-12-22(13-15-26)25-18-16-24(17-19-25)21-8-2-1-3-9-21;3-1(4)2(5)6/h1-3,8-9,20,22H,4-7,10-19H2;(H,3,4)(H,5,6)