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

Systemtic Name: [4-(phenylmethyl)piperazin-1-yl]-[1-[(4-phenylphenyl)methyl]piperidin-1-ium-4-yl]methanone Openeye Name: (4-benzylpiperazin-1-yl)-[1-[(4-phenylphenyl)methyl]piperidin-1-ium-4-yl]methanone CAS Name: [4-(phenylmethyl)-1-piperazinyl]-[1-[(4-phenylphenyl)methyl]-4-piperidin-1-iumyl]methanone IUPAC Name: (4-benzylpiperazin-1-yl)-[1-[(4-phenylphenyl)methyl]piperidin-1-ium-4-yl]methanone Traditional Name: (4-benzylpiperazino)-[1-(4-phenylbenzyl)piperidin-1-ium-4-yl]methanone Formula: C30H36N3O+ MolecularWeight: 454.62634

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1C(=O)N2CCN(CC2)CC3=CC=CC=C3)CC4=CC=C(C=C4)C5=CC=CC=C5

Isomeric SMILES

C1C[NH+](CCC1C(=O)N2CCN(CC2)CC3=CC=CC=C3)CC4=CC=C(C=C4)C5=CC=CC=C5

InChI

InChI=1S/C30H35N3O/c34-30(33-21-19-32(20-22-33)23-25-7-3-1-4-8-25)29-15-17-31(18-16-29)24-26-11-13-28(14-12-26)27-9-5-2-6-10-27/h1-14,29H,15-24H2/p+1