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2-tert-butyl-4-methyl-6-[(4-phenylpiperazin-1-ium-1-yl)methyl]phenol

2-tert-butyl-4-methyl-6-[(4-phenylpiperazin-1-ium-1-yl)methyl]phenol

Systemtic Name:2-tert-butyl-4-methyl-6-[(4-phenylpiperazin-1-ium-1-yl)methyl]phenol
Openeye Name:2-tert-butyl-4-methyl-6-[(4-phenylpiperazin-1-ium-1-yl)methyl]phenol
CAS Name:2-tert-butyl-4-methyl-6-[(4-phenyl-1-piperazin-1-iumyl)methyl]phenol
IUPAC Name:2-tert-butyl-4-methyl-6-[(4-phenylpiperazin-1-ium-1-yl)methyl]phenol
Traditional Name:2-tert-butyl-4-methyl-6-[(4-phenylpiperazin-1-ium-1-yl)methyl]phenol
Formula: C22H31N2O+
MolecularWeight: 339.49434
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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C(C)(C)C)O)C[NH+]2CCN(CC2)C3=CC=CC=C3


Isomeric SMILES

CC1=CC(=C(C(=C1)C(C)(C)C)O)C[NH+]2CCN(CC2)C3=CC=CC=C3


InChI

InChI=1S/C22H30N2O/c1-17-14-18(21(25)20(15-17)22(2,3)4)16-23-10-12-24(13-11-23)19-8-6-5-7-9-19/h5-9,14-15,25H,10-13,16H2,1-4H3/p+1


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