1-[3-(4-chloranyl-5-methyl-2-propan-2-yl-phenoxy)propyl]-4-methyl-piperazin-4-ium

Systemtic Name: 1-[3-(4-chloranyl-5-methyl-2-propan-2-yl-phenoxy)propyl]-4-methyl-piperazin-4-ium Openeye Name: 1-[3-(4-chloro-2-isopropyl-5-methyl-phenoxy)propyl]-4-methyl-piperazin-4-ium CAS Name: 1-[3-(4-chloro-5-methyl-2-propan-2-ylphenoxy)propyl]-4-methylpiperazin-4-ium IUPAC Name: 1-[3-(4-chloro-5-methyl-2-propan-2-ylphenoxy)propyl]-4-methylpiperazin-4-ium Traditional Name: 1-[3-(4-chloro-2-isopropyl-5-methyl-phenoxy)propyl]-4-methyl-piperazin-4-ium Formula: C18H30ClN2O+ MolecularWeight: 325.8966

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1Cl)C(C)C)OCCCN2CC[NH+](CC2)C

Isomeric SMILES

CC1=CC(=C(C=C1Cl)C(C)C)OCCCN2CC[NH+](CC2)C

InChI

InChI=1S/C18H29ClN2O/c1-14(2)16-13-17(19)15(3)12-18(16)22-11-5-6-21-9-7-20(4)8-10-21/h12-14H,5-11H2,1-4H3/p+1