2-azaniumylethyl-[(2S)-butan-2-yl]-[(4-tert-butylphenyl)methyl]azanium

Systemtic Name: 2-azaniumylethyl-[(2S)-butan-2-yl]-[(4-tert-butylphenyl)methyl]azanium Openeye Name: 2-azaniumylethyl-[(4-tert-butylphenyl)methyl]-[(1S)-1-methylpropyl]ammonium CAS Name: 2-ammonioethyl-[(2S)-butan-2-yl]-[(4-tert-butylphenyl)methyl]ammonium IUPAC Name: 2-azaniumylethyl-[(2S)-butan-2-yl]-[(4-tert-butylphenyl)methyl]azanium Traditional Name: 2-ammonioethyl-(4-tert-butylbenzyl)-[(1S)-1-methylpropyl]ammonium Formula: C17H32N2+2 MolecularWeight: 264.44938

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)[NH+](CC[NH3+])CC1=CC=C(C=C1)C(C)(C)C

Isomeric SMILES

CC[C@H](C)[NH+](CC[NH3+])CC1=CC=C(C=C1)C(C)(C)C

InChI

InChI=1S/C17H30N2/c1-6-14(2)19(12-11-18)13-15-7-9-16(10-8-15)17(3,4)5/h7-10,14H,6,11-13,18H2,1-5H3/p+2/t14-/m0/s1