[(2R)-butan-2-yl]-[3-(2-tert-butyl-4-chloranyl-phenoxy)propyl]azanium

Systemtic Name: [(2R)-butan-2-yl]-[3-(2-tert-butyl-4-chloranyl-phenoxy)propyl]azanium Openeye Name: 3-(2-tert-butyl-4-chloro-phenoxy)propyl-[(1R)-1-methylpropyl]ammonium CAS Name: [(2R)-butan-2-yl]-[3-(2-tert-butyl-4-chlorophenoxy)propyl]ammonium IUPAC Name: [(2R)-butan-2-yl]-[3-(2-tert-butyl-4-chlorophenoxy)propyl]azanium Traditional Name: 3-(2-tert-butyl-4-chloro-phenoxy)propyl-[(1R)-1-methylpropyl]ammonium Formula: C17H29ClNO+ MolecularWeight: 298.87126

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)[NH2+]CCCOC1=C(C=C(C=C1)Cl)C(C)(C)C

Isomeric SMILES

CC[C@@H](C)[NH2+]CCCOC1=C(C=C(C=C1)Cl)C(C)(C)C

InChI

InChI=1S/C17H28ClNO/c1-6-13(2)19-10-7-11-20-16-9-8-14(18)12-15(16)17(3,4)5/h8-9,12-13,19H,6-7,10-11H2,1-5H3/p+1/t13-/m1/s1