1-methyl-4-[4-(4-methyl-2-prop-2-enyl-phenoxy)butyl]piperazine-1,4-diium

Systemtic Name: 1-methyl-4-[4-(4-methyl-2-prop-2-enyl-phenoxy)butyl]piperazine-1,4-diium Openeye Name: 1-[4-(2-allyl-4-methyl-phenoxy)butyl]-4-methyl-piperazine-1,4-diium CAS Name: 1-methyl-4-[4-(4-methyl-2-prop-2-enylphenoxy)butyl]piperazine-1,4-diium IUPAC Name: 1-methyl-4-[4-(4-methyl-2-prop-2-enylphenoxy)butyl]piperazine-1,4-diium Traditional Name: 1-[4-(2-allyl-4-methyl-phenoxy)butyl]-4-methyl-piperazine-1,4-diium Formula: C19H32N2O+2 MolecularWeight: 304.47018

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OCCCC[NH+]2CC[NH+](CC2)C)CC=C

Isomeric SMILES

CC1=CC(=C(C=C1)OCCCC[NH+]2CC[NH+](CC2)C)CC=C

InChI

InChI=1S/C19H30N2O/c1-4-7-18-16-17(2)8-9-19(18)22-15-6-5-10-21-13-11-20(3)12-14-21/h4,8-9,16H,1,5-7,10-15H2,2-3H3/p+2