1-[3-(3-tert-butylphenoxy)propyl]-4-methyl-piperazin-4-ium

Systemtic Name: 1-[3-(3-tert-butylphenoxy)propyl]-4-methyl-piperazin-4-ium Openeye Name: 1-[3-(3-tert-butylphenoxy)propyl]-4-methyl-piperazin-4-ium CAS Name: 1-[3-(3-tert-butylphenoxy)propyl]-4-methylpiperazin-4-ium IUPAC Name: 1-[3-(3-tert-butylphenoxy)propyl]-4-methylpiperazin-4-ium Traditional Name: 1-[3-(3-tert-butylphenoxy)propyl]-4-methyl-piperazin-4-ium Formula: C18H31N2O+ MolecularWeight: 291.45154

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC=C1)OCCCN2CC[NH+](CC2)C

Isomeric SMILES

CC(C)(C)C1=CC(=CC=C1)OCCCN2CC[NH+](CC2)C

InChI

InChI=1S/C18H30N2O/c1-18(2,3)16-7-5-8-17(15-16)21-14-6-9-20-12-10-19(4)11-13-20/h5,7-8,15H,6,9-14H2,1-4H3/p+1