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

Systemtic Name: 4-[(4-chlorophenyl)-phenyl-methyl]-1-methyl-1-propan-2-yl-piperazin-1-ium Openeye Name: 4-[(4-chlorophenyl)-phenyl-methyl]-1-isopropyl-1-methyl-piperazin-1-ium CAS Name: 4-[(4-chlorophenyl)-phenylmethyl]-1-methyl-1-propan-2-ylpiperazin-1-ium IUPAC Name: 4-[(4-chlorophenyl)-phenylmethyl]-1-methyl-1-propan-2-ylpiperazin-1-ium Traditional Name: 4-[(4-chlorophenyl)-phenyl-methyl]-1-isopropyl-1-methyl-piperazin-1-ium Formula: C21H28ClN2+ MolecularWeight: 343.91342

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H28ClN2/c1-17(2)24(3)15-13-23(14-16-24)21(18-7-5-4-6-8-18)19-9-11-20(22)12-10-19/h4-12,17,21H,13-16H2,1-3H3/q+1