1-methyl-4-[4-(3-propan-2-ylphenoxy)butyl]piperazin-4-ium

Systemtic Name: 1-methyl-4-[4-(3-propan-2-ylphenoxy)butyl]piperazin-4-ium Openeye Name: 1-[4-(3-isopropylphenoxy)butyl]-4-methyl-piperazin-1-ium CAS Name: 1-methyl-4-[4-(3-propan-2-ylphenoxy)butyl]piperazin-4-ium IUPAC Name: 1-methyl-4-[4-(3-propan-2-ylphenoxy)butyl]piperazin-4-ium Traditional Name: 1-[4-(3-isopropylphenoxy)butyl]-4-methyl-piperazin-1-ium Formula: C18H31N2O+ MolecularWeight: 291.45154

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=CC=C1)OCCCC[NH+]2CCN(CC2)C

Isomeric SMILES

CC(C)C1=CC(=CC=C1)OCCCC[NH+]2CCN(CC2)C

InChI

InChI=1S/C18H30N2O/c1-16(2)17-7-6-8-18(15-17)21-14-5-4-9-20-12-10-19(3)11-13-20/h6-8,15-16H,4-5,9-14H2,1-3H3/p+1