1-cyclopentyl-4-[(3-phenoxyphenyl)methyl]piperazin-1-ium

Systemtic Name: 1-cyclopentyl-4-[(3-phenoxyphenyl)methyl]piperazin-1-ium Openeye Name: 1-cyclopentyl-4-[(3-phenoxyphenyl)methyl]piperazin-1-ium CAS Name: 1-cyclopentyl-4-[(3-phenoxyphenyl)methyl]piperazin-1-ium IUPAC Name: 1-cyclopentyl-4-[(3-phenoxyphenyl)methyl]piperazin-1-ium Traditional Name: 1-cyclopentyl-4-(3-phenoxybenzyl)piperazin-1-ium Formula: C22H29N2O+ MolecularWeight: 337.47846

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)[NH+]2CCN(CC2)CC3=CC(=CC=C3)OC4=CC=CC=C4

Isomeric SMILES

C1CCC(C1)[NH+]2CCN(CC2)CC3=CC(=CC=C3)OC4=CC=CC=C4

InChI

InChI=1S/C22H28N2O/c1-2-10-21(11-3-1)25-22-12-6-7-19(17-22)18-23-13-15-24(16-14-23)20-8-4-5-9-20/h1-3,6-7,10-12,17,20H,4-5,8-9,13-16,18H2/p+1