(3-methoxyphenyl)-[4-[(3-phenoxyphenyl)methyl]piperazin-4-ium-1-yl]methanone

Systemtic Name: (3-methoxyphenyl)-[4-[(3-phenoxyphenyl)methyl]piperazin-4-ium-1-yl]methanone Openeye Name: (3-methoxyphenyl)-[4-[(3-phenoxyphenyl)methyl]piperazin-4-ium-1-yl]methanone CAS Name: (3-methoxyphenyl)-[4-[(3-phenoxyphenyl)methyl]-1-piperazin-4-iumyl]methanone IUPAC Name: (3-methoxyphenyl)-[4-[(3-phenoxyphenyl)methyl]piperazin-4-ium-1-yl]methanone Traditional Name: (3-methoxyphenyl)-[4-(3-phenoxybenzyl)piperazin-4-ium-1-yl]methanone Formula: C25H27N2O3+ MolecularWeight: 403.49348

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C(=O)N2CC[NH+](CC2)CC3=CC(=CC=C3)OC4=CC=CC=C4

Isomeric SMILES

COC1=CC=CC(=C1)C(=O)N2CC[NH+](CC2)CC3=CC(=CC=C3)OC4=CC=CC=C4

InChI

InChI=1S/C25H26N2O3/c1-29-23-11-6-8-21(18-23)25(28)27-15-13-26(14-16-27)19-20-7-5-12-24(17-20)30-22-9-3-2-4-10-22/h2-12,17-18H,13-16,19H2,1H3/p+1