[(2S)-2-(4-butoxy-3-methoxy-phenyl)-2-oxidanyl-ethyl]-ethyl-azanium

Systemtic Name: [(2S)-2-(4-butoxy-3-methoxy-phenyl)-2-oxidanyl-ethyl]-ethyl-azanium Openeye Name: [(2S)-2-(4-butoxy-3-methoxy-phenyl)-2-hydroxy-ethyl]-ethyl-ammonium CAS Name: [(2S)-2-(4-butoxy-3-methoxyphenyl)-2-hydroxyethyl]-ethylammonium IUPAC Name: [(2S)-2-(4-butoxy-3-methoxyphenyl)-2-hydroxyethyl]-ethylazanium Traditional Name: [(2S)-2-(4-butoxy-3-methoxy-phenyl)-2-hydroxy-ethyl]-ethyl-ammonium Formula: C15H26NO3+ MolecularWeight: 268.37184

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)C(C[NH2+]CC)O)OC

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)[C@@H](C[NH2+]CC)O)OC

InChI

InChI=1S/C15H25NO3/c1-4-6-9-19-14-8-7-12(10-15(14)18-3)13(17)11-16-5-2/h7-8,10,13,16-17H,4-6,9,11H2,1-3H3/p+1/t13-/m1/s1