1-[4-[(3-chlorophenyl)methyl]piperazin-4-ium-1-yl]-3-cyclopentyl-propan-1-one

Systemtic Name: 1-[4-[(3-chlorophenyl)methyl]piperazin-4-ium-1-yl]-3-cyclopentyl-propan-1-one Openeye Name: 1-[4-[(3-chlorophenyl)methyl]piperazin-4-ium-1-yl]-3-cyclopentyl-propan-1-one CAS Name: 1-[4-[(3-chlorophenyl)methyl]-1-piperazin-4-iumyl]-3-cyclopentyl-1-propanone IUPAC Name: 1-[4-[(3-chlorophenyl)methyl]piperazin-4-ium-1-yl]-3-cyclopentylpropan-1-one Traditional Name: 1-[4-(3-chlorobenzyl)piperazin-4-ium-1-yl]-3-cyclopentyl-propan-1-one Formula: C19H28ClN2O+ MolecularWeight: 335.89142

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)CCC(=O)N2CC[NH+](CC2)CC3=CC(=CC=C3)Cl

Isomeric SMILES

C1CCC(C1)CCC(=O)N2CC[NH+](CC2)CC3=CC(=CC=C3)Cl

InChI

InChI=1S/C19H27ClN2O/c20-18-7-3-6-17(14-18)15-21-10-12-22(13-11-21)19(23)9-8-16-4-1-2-5-16/h3,6-7,14,16H,1-2,4-5,8-13,15H2/p+1