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

Systemtic Name: 4-[cyclohexen-1-yl(phenyl)methyl]-1-methyl-1-propan-2-yl-piperazin-1-ium Openeye Name: 4-[cyclohexen-1-yl(phenyl)methyl]-1-isopropyl-1-methyl-piperazin-1-ium CAS Name: 4-[1-cyclohexenyl(phenyl)methyl]-1-methyl-1-propan-2-ylpiperazin-1-ium IUPAC Name: 4-[cyclohexen-1-yl(phenyl)methyl]-1-methyl-1-propan-2-ylpiperazin-1-ium Traditional Name: 4-[cyclohexen-1-yl(phenyl)methyl]-1-isopropyl-1-methyl-piperazin-1-ium Formula: C21H33N2+ MolecularWeight: 313.50012

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[N+]1(CCN(CC1)C(C2=CCCCC2)C3=CC=CC=C3)C

Isomeric SMILES

CC(C)[N+]1(CCN(CC1)C(C2=CCCCC2)C3=CC=CC=C3)C

InChI

InChI=1S/C21H33N2/c1-18(2)23(3)16-14-22(15-17-23)21(19-10-6-4-7-11-19)20-12-8-5-9-13-20/h4,6-7,10-12,18,21H,5,8-9,13-17H2,1-3H3/q+1