[4-(2-ethoxyphenyl)piperazin-1-yl]-[1-[(4-phenylmethoxyphenyl)methyl]piperidin-1-ium-4-yl]methanone

Systemtic Name: [4-(2-ethoxyphenyl)piperazin-1-yl]-[1-[(4-phenylmethoxyphenyl)methyl]piperidin-1-ium-4-yl]methanone Openeye Name: [1-[(4-benzyloxyphenyl)methyl]piperidin-1-ium-4-yl]-[4-(2-ethoxyphenyl)piperazin-1-yl]methanone CAS Name: [4-(2-ethoxyphenyl)-1-piperazinyl]-[1-[(4-phenylmethoxyphenyl)methyl]-4-piperidin-1-iumyl]methanone IUPAC Name: [4-(2-ethoxyphenyl)piperazin-1-yl]-[1-[(4-phenylmethoxyphenyl)methyl]piperidin-1-ium-4-yl]methanone Traditional Name: [1-(4-benzoxybenzyl)piperidin-1-ium-4-yl]-(4-o-phenetylpiperazino)methanone Formula: C32H40N3O3+ MolecularWeight: 514.6783

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1N2CCN(CC2)C(=O)C3CC[NH+](CC3)CC4=CC=C(C=C4)OCC5=CC=CC=C5

Isomeric SMILES

CCOC1=CC=CC=C1N2CCN(CC2)C(=O)C3CC[NH+](CC3)CC4=CC=C(C=C4)OCC5=CC=CC=C5

InChI

InChI=1S/C32H39N3O3/c1-2-37-31-11-7-6-10-30(31)34-20-22-35(23-21-34)32(36)28-16-18-33(19-17-28)24-26-12-14-29(15-13-26)38-25-27-8-4-3-5-9-27/h3-15,28H,2,16-25H2,1H3/p+1