[1-(cyclohexylmethyl)piperidin-1-ium-4-yl]-[4-(phenylmethyl)piperazin-4-ium-1-yl]methanone

Systemtic Name: [1-(cyclohexylmethyl)piperidin-1-ium-4-yl]-[4-(phenylmethyl)piperazin-4-ium-1-yl]methanone Openeye Name: (4-benzylpiperazin-4-ium-1-yl)-[1-(cyclohexylmethyl)piperidin-1-ium-4-yl]methanone CAS Name: [1-(cyclohexylmethyl)-4-piperidin-1-iumyl]-[4-(phenylmethyl)-1-piperazin-4-iumyl]methanone IUPAC Name: (4-benzylpiperazin-4-ium-1-yl)-[1-(cyclohexylmethyl)piperidin-1-ium-4-yl]methanone Traditional Name: (4-benzylpiperazin-4-ium-1-yl)-[1-(cyclohexylmethyl)piperidin-1-ium-4-yl]methanone Formula: C24H39N3O+2 MolecularWeight: 385.58596

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C[NH+]2CCC(CC2)C(=O)N3CC[NH+](CC3)CC4=CC=CC=C4

Isomeric SMILES

C1CCC(CC1)C[NH+]2CCC(CC2)C(=O)N3CC[NH+](CC3)CC4=CC=CC=C4

InChI

InChI=1S/C24H37N3O/c28-24(23-11-13-25(14-12-23)19-21-7-3-1-4-8-21)27-17-15-26(16-18-27)20-22-9-5-2-6-10-22/h2,5-6,9-10,21,23H,1,3-4,7-8,11-20H2/p+2