3-[4-[(4-tert-butylphenyl)methyl]piperazin-1-ium-1-yl]propylazanium

Systemtic Name: 3-[4-[(4-tert-butylphenyl)methyl]piperazin-1-ium-1-yl]propylazanium Openeye Name: 3-[4-[(4-tert-butylphenyl)methyl]piperazin-1-ium-1-yl]propylammonium CAS Name: 3-[4-[(4-tert-butylphenyl)methyl]-1-piperazin-1-iumyl]propylammonium IUPAC Name: 3-[4-[(4-tert-butylphenyl)methyl]piperazin-1-ium-1-yl]propylazanium Traditional Name: 3-[4-(4-tert-butylbenzyl)piperazin-1-ium-1-yl]propylammonium Formula: C18H33N3+2 MolecularWeight: 291.47472

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)CN2CC[NH+](CC2)CCC[NH3+]

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)CN2CC[NH+](CC2)CCC[NH3+]

InChI

InChI=1S/C18H31N3/c1-18(2,3)17-7-5-16(6-8-17)15-21-13-11-20(12-14-21)10-4-9-19/h5-8H,4,9-15,19H2,1-3H3/p+2