[(2S)-1-ethylpyrrolidin-2-yl]methyl-[(1S)-1-(4-methoxy-2-oxidanyl-phenyl)ethyl]azanium

Systemtic Name: [(2S)-1-ethylpyrrolidin-2-yl]methyl-[(1S)-1-(4-methoxy-2-oxidanyl-phenyl)ethyl]azanium Openeye Name: [(2S)-1-ethylpyrrolidin-2-yl]methyl-[(1S)-1-(2-hydroxy-4-methoxy-phenyl)ethyl]ammonium CAS Name: [(2S)-1-ethyl-2-pyrrolidinyl]methyl-[(1S)-1-(2-hydroxy-4-methoxyphenyl)ethyl]ammonium IUPAC Name: [(2S)-1-ethylpyrrolidin-2-yl]methyl-[(1S)-1-(2-hydroxy-4-methoxyphenyl)ethyl]azanium Traditional Name: [(2S)-1-ethylpyrrolidin-2-yl]methyl-[(1S)-1-(2-hydroxy-4-methoxy-phenyl)ethyl]ammonium Formula: C16H27N2O2+ MolecularWeight: 279.39778

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCCC1C[NH2+]C(C)C2=C(C=C(C=C2)OC)O

Isomeric SMILES

CCN1CCC[C@H]1C[NH2+][C@@H](C)C2=C(C=C(C=C2)OC)O

InChI

InChI=1S/C16H26N2O2/c1-4-18-9-5-6-13(18)11-17-12(2)15-8-7-14(20-3)10-16(15)19/h7-8,10,12-13,17,19H,4-6,9,11H2,1-3H3/p+1/t12-,13-/m0/s1