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

Systemtic Name: [1-[(4-ethylphenyl)methyl]piperidin-1-ium-4-yl]-[4-(phenylmethyl)piperazin-4-ium-1-yl]methanone Openeye Name: (4-benzylpiperazin-4-ium-1-yl)-[1-[(4-ethylphenyl)methyl]piperidin-1-ium-4-yl]methanone CAS Name: [1-[(4-ethylphenyl)methyl]-4-piperidin-1-iumyl]-[4-(phenylmethyl)-1-piperazin-4-iumyl]methanone IUPAC Name: (4-benzylpiperazin-4-ium-1-yl)-[1-[(4-ethylphenyl)methyl]piperidin-1-ium-4-yl]methanone Traditional Name: (4-benzylpiperazin-4-ium-1-yl)-[1-(4-ethylbenzyl)piperidin-1-ium-4-yl]methanone Formula: C26H37N3O+2 MolecularWeight: 407.59148

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C[NH+]2CCC(CC2)C(=O)N3CC[NH+](CC3)CC4=CC=CC=C4

Isomeric SMILES

CCC1=CC=C(C=C1)C[NH+]2CCC(CC2)C(=O)N3CC[NH+](CC3)CC4=CC=CC=C4

InChI

InChI=1S/C26H35N3O/c1-2-22-8-10-24(11-9-22)21-27-14-12-25(13-15-27)26(30)29-18-16-28(17-19-29)20-23-6-4-3-5-7-23/h3-11,25H,2,12-21H2,1H3/p+2