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

Systemtic Name: [(2R)-butan-2-yl]-[4-(2-tert-butyl-4-chloranyl-phenoxy)butyl]azanium Openeye Name: 4-(2-tert-butyl-4-chloro-phenoxy)butyl-[(1R)-1-methylpropyl]ammonium CAS Name: [(2R)-butan-2-yl]-[4-(2-tert-butyl-4-chlorophenoxy)butyl]ammonium IUPAC Name: [(2R)-butan-2-yl]-[4-(2-tert-butyl-4-chlorophenoxy)butyl]azanium Traditional Name: 4-(2-tert-butyl-4-chloro-phenoxy)butyl-[(1R)-1-methylpropyl]ammonium Formula: C18H31ClNO+ MolecularWeight: 312.89784

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)[NH2+]CCCCOC1=C(C=C(C=C1)Cl)C(C)(C)C

Isomeric SMILES

CC[C@@H](C)[NH2+]CCCCOC1=C(C=C(C=C1)Cl)C(C)(C)C

InChI

InChI=1S/C18H30ClNO/c1-6-14(2)20-11-7-8-12-21-17-10-9-15(19)13-16(17)18(3,4)5/h9-10,13-14,20H,6-8,11-12H2,1-5H3/p+1/t14-/m1/s1