(4-tert-butylphenyl)methyl-[(1S)-1-pyridin-4-ylethyl]azanium

Systemtic Name: (4-tert-butylphenyl)methyl-[(1S)-1-pyridin-4-ylethyl]azanium Openeye Name: (4-tert-butylphenyl)methyl-[(1S)-1-(4-pyridyl)ethyl]ammonium CAS Name: (4-tert-butylphenyl)methyl-[(1S)-1-pyridin-4-ylethyl]ammonium IUPAC Name: (4-tert-butylphenyl)methyl-[(1S)-1-pyridin-4-ylethyl]azanium Traditional Name: (4-tert-butylbenzyl)-[(1S)-1-(4-pyridyl)ethyl]ammonium Formula: C18H25N2+ MolecularWeight: 269.4045

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=NC=C1)[NH2+]CC2=CC=C(C=C2)C(C)(C)C

Isomeric SMILES

C[C@@H](C1=CC=NC=C1)[NH2+]CC2=CC=C(C=C2)C(C)(C)C

InChI

InChI=1S/C18H24N2/c1-14(16-9-11-19-12-10-16)20-13-15-5-7-17(8-6-15)18(2,3)4/h5-12,14,20H,13H2,1-4H3/p+1/t14-/m0/s1