[4-(phenylmethyl)piperazin-1-yl]-[1-(3-phenylpropyl)piperidin-1-ium-4-yl]methanone

Systemtic Name: [4-(phenylmethyl)piperazin-1-yl]-[1-(3-phenylpropyl)piperidin-1-ium-4-yl]methanone Openeye Name: (4-benzylpiperazin-1-yl)-[1-(3-phenylpropyl)piperidin-1-ium-4-yl]methanone CAS Name: [4-(phenylmethyl)-1-piperazinyl]-[1-(3-phenylpropyl)-4-piperidin-1-iumyl]methanone IUPAC Name: (4-benzylpiperazin-1-yl)-[1-(3-phenylpropyl)piperidin-1-ium-4-yl]methanone Traditional Name: (4-benzylpiperazino)-[1-(3-phenylpropyl)piperidin-1-ium-4-yl]methanone Formula: C26H36N3O+ MolecularWeight: 406.58354

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1C(=O)N2CCN(CC2)CC3=CC=CC=C3)CCCC4=CC=CC=C4

Isomeric SMILES

C1C[NH+](CCC1C(=O)N2CCN(CC2)CC3=CC=CC=C3)CCCC4=CC=CC=C4

InChI

InChI=1S/C26H35N3O/c30-26(29-20-18-28(19-21-29)22-24-10-5-2-6-11-24)25-13-16-27(17-14-25)15-7-12-23-8-3-1-4-9-23/h1-6,8-11,25H,7,12-22H2/p+1