[(1S)-1-[4-(2-methylpropoxy)phenyl]ethyl]-(2-pyrrolidin-1-ylethyl)azanium

Systemtic Name: [(1S)-1-[4-(2-methylpropoxy)phenyl]ethyl]-(2-pyrrolidin-1-ylethyl)azanium Openeye Name: [(1S)-1-(4-isobutoxyphenyl)ethyl]-(2-pyrrolidin-1-ylethyl)ammonium CAS Name: [(1S)-1-[4-(2-methylpropoxy)phenyl]ethyl]-[2-(1-pyrrolidinyl)ethyl]ammonium IUPAC Name: [(1S)-1-[4-(2-methylpropoxy)phenyl]ethyl]-(2-pyrrolidin-1-ylethyl)azanium Traditional Name: [(1S)-1-(4-isobutoxyphenyl)ethyl]-(2-pyrrolidinoethyl)ammonium Formula: C18H31N2O+ MolecularWeight: 291.45154

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=CC=C(C=C1)C(C)[NH2+]CCN2CCCC2

Isomeric SMILES

C[C@@H](C1=CC=C(C=C1)OCC(C)C)[NH2+]CCN2CCCC2

InChI

InChI=1S/C18H30N2O/c1-15(2)14-21-18-8-6-17(7-9-18)16(3)19-10-13-20-11-4-5-12-20/h6-9,15-16,19H,4-5,10-14H2,1-3H3/p+1/t16-/m0/s1