[(2R)-pentan-2-yl]-[(1S)-1-(4-propoxyphenyl)ethyl]azanium

Systemtic Name: [(2R)-pentan-2-yl]-[(1S)-1-(4-propoxyphenyl)ethyl]azanium Openeye Name: [(1R)-1-methylbutyl]-[(1S)-1-(4-propoxyphenyl)ethyl]ammonium CAS Name: [(2R)-pentan-2-yl]-[(1S)-1-(4-propoxyphenyl)ethyl]ammonium IUPAC Name: [(2R)-pentan-2-yl]-[(1S)-1-(4-propoxyphenyl)ethyl]azanium Traditional Name: [(1R)-1-methylbutyl]-[(1S)-1-(4-propoxyphenyl)ethyl]ammonium Formula: C16H28NO+ MolecularWeight: 250.39962

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)[NH2+]C(C)C1=CC=C(C=C1)OCCC

Isomeric SMILES

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

InChI

InChI=1S/C16H27NO/c1-5-7-13(3)17-14(4)15-8-10-16(11-9-15)18-12-6-2/h8-11,13-14,17H,5-7,12H2,1-4H3/p+1/t13-,14+/m1/s1