[(2S)-1-ethylpyrrolidin-2-yl]methyl-[(1S)-1-(3-methoxy-4-oxidanyl-phenyl)ethyl]azanium

Systemtic Name: [(2S)-1-ethylpyrrolidin-2-yl]methyl-[(1S)-1-(3-methoxy-4-oxidanyl-phenyl)ethyl]azanium Openeye Name: [(2S)-1-ethylpyrrolidin-2-yl]methyl-[(1S)-1-(4-hydroxy-3-methoxy-phenyl)ethyl]ammonium CAS Name: [(2S)-1-ethyl-2-pyrrolidinyl]methyl-[(1S)-1-(4-hydroxy-3-methoxyphenyl)ethyl]ammonium IUPAC Name: [(2S)-1-ethylpyrrolidin-2-yl]methyl-[(1S)-1-(4-hydroxy-3-methoxyphenyl)ethyl]azanium Traditional Name: [(2S)-1-ethylpyrrolidin-2-yl]methyl-[(1S)-1-(4-hydroxy-3-methoxy-phenyl)ethyl]ammonium Formula: C16H27N2O2+ MolecularWeight: 279.39778

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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