[(2R)-butan-2-yl]-[4-(2,5-dimethylphenoxy)butyl]azanium

Systemtic Name: [(2R)-butan-2-yl]-[4-(2,5-dimethylphenoxy)butyl]azanium Openeye Name: 4-(2,5-dimethylphenoxy)butyl-[(1R)-1-methylpropyl]ammonium CAS Name: [(2R)-butan-2-yl]-[4-(2,5-dimethylphenoxy)butyl]ammonium IUPAC Name: [(2R)-butan-2-yl]-[4-(2,5-dimethylphenoxy)butyl]azanium Traditional Name: 4-(2,5-dimethylphenoxy)butyl-[(1R)-1-methylpropyl]ammonium Formula: C16H28NO+ MolecularWeight: 250.39962

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H27NO/c1-5-15(4)17-10-6-7-11-18-16-12-13(2)8-9-14(16)3/h8-9,12,15,17H,5-7,10-11H2,1-4H3/p+1/t15-/m1/s1