[(1S)-1-(4-ethoxyphenyl)ethyl]-(3-pyrrolidin-1-ium-1-ylpropyl)azanium

Systemtic Name: [(1S)-1-(4-ethoxyphenyl)ethyl]-(3-pyrrolidin-1-ium-1-ylpropyl)azanium Openeye Name: [(1S)-1-(4-ethoxyphenyl)ethyl]-(3-pyrrolidin-1-ium-1-ylpropyl)ammonium CAS Name: [(1S)-1-(4-ethoxyphenyl)ethyl]-[3-(1-pyrrolidin-1-iumyl)propyl]ammonium IUPAC Name: [(1S)-1-(4-ethoxyphenyl)ethyl]-(3-pyrrolidin-1-ium-1-ylpropyl)azanium Traditional Name: [(1S)-1-p-phenetylethyl]-(3-pyrrolidin-1-ium-1-ylpropyl)ammonium Formula: C17H30N2O+2 MolecularWeight: 278.4329

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C(C)[NH2+]CCC[NH+]2CCCC2

Isomeric SMILES

CCOC1=CC=C(C=C1)[C@H](C)[NH2+]CCC[NH+]2CCCC2

InChI

InChI=1S/C17H28N2O/c1-3-20-17-9-7-16(8-10-17)15(2)18-11-6-14-19-12-4-5-13-19/h7-10,15,18H,3-6,11-14H2,1-2H3/p+2/t15-/m0/s1