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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(C[NH2+]CC(C)C)O)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1)[C@@H](C[NH2+]CC(C)C)O)OC

InChI

InChI=1S/C15H25NO3/c1-5-19-14-7-6-12(8-15(14)18-4)13(17)10-16-9-11(2)3/h6-8,11,13,16-17H,5,9-10H2,1-4H3/p+1/t13-/m1/s1