[(1S)-2-azaniumyl-1-(4-tert-butylphenyl)ethyl]-methyl-propan-2-yl-azanium

Systemtic Name: [(1S)-2-azaniumyl-1-(4-tert-butylphenyl)ethyl]-methyl-propan-2-yl-azanium Openeye Name: [(1S)-2-azaniumyl-1-(4-tert-butylphenyl)ethyl]-isopropyl-methyl-ammonium CAS Name: [(1S)-2-ammonio-1-(4-tert-butylphenyl)ethyl]-methyl-propan-2-ylammonium IUPAC Name: [(1S)-2-azaniumyl-1-(4-tert-butylphenyl)ethyl]-methyl-propan-2-ylazanium Traditional Name: [(1S)-2-ammonio-1-(4-tert-butylphenyl)ethyl]-isopropyl-methyl-ammonium Formula: C16H30N2+2 MolecularWeight: 250.4228

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H28N2/c1-12(2)18(6)15(11-17)13-7-9-14(10-8-13)16(3,4)5/h7-10,12,15H,11,17H2,1-6H3/p+2/t15-/m1/s1