1-[4-(2,4,6-trimethylphenoxy)butyl]piperazin-4-ium

Systemtic Name: 1-[4-(2,4,6-trimethylphenoxy)butyl]piperazin-4-ium Openeye Name: 1-[4-(2,4,6-trimethylphenoxy)butyl]piperazin-4-ium CAS Name: 1-[4-(2,4,6-trimethylphenoxy)butyl]piperazin-4-ium IUPAC Name: 1-[4-(2,4,6-trimethylphenoxy)butyl]piperazin-4-ium Traditional Name: 1-[4-(2,4,6-trimethylphenoxy)butyl]piperazin-4-ium Formula: C17H29N2O+ MolecularWeight: 277.42496

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)OCCCCN2CC[NH2+]CC2)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)OCCCCN2CC[NH2+]CC2)C

InChI

InChI=1S/C17H28N2O/c1-14-12-15(2)17(16(3)13-14)20-11-5-4-8-19-9-6-18-7-10-19/h12-13,18H,4-11H2,1-3H3/p+1