1-[(4-chlorophenyl)methyl]-4-propan-2-yl-piperazin-4-ium

Systemtic Name: 1-[(4-chlorophenyl)methyl]-4-propan-2-yl-piperazin-4-ium Openeye Name: 1-[(4-chlorophenyl)methyl]-4-isopropyl-piperazin-4-ium CAS Name: 1-[(4-chlorophenyl)methyl]-4-propan-2-ylpiperazin-4-ium IUPAC Name: 1-[(4-chlorophenyl)methyl]-4-propan-2-ylpiperazin-4-ium Traditional Name: 1-(4-chlorobenzyl)-4-isopropyl-piperazin-4-ium Formula: C14H22ClN2+ MolecularWeight: 253.79088

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[NH+]1CCN(CC1)CC2=CC=C(C=C2)Cl

Isomeric SMILES

CC(C)[NH+]1CCN(CC1)CC2=CC=C(C=C2)Cl

InChI

InChI=1S/C14H21ClN2/c1-12(2)17-9-7-16(8-10-17)11-13-3-5-14(15)6-4-13/h3-6,12H,7-11H2,1-2H3/p+1