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

Systemtic Name: [(2S)-2-(3-butoxy-4-methoxy-phenyl)-2-oxidanyl-ethyl]-methyl-azanium Openeye Name: [(2S)-2-(3-butoxy-4-methoxy-phenyl)-2-hydroxy-ethyl]-methyl-ammonium CAS Name: [(2S)-2-(3-butoxy-4-methoxyphenyl)-2-hydroxyethyl]-methylammonium IUPAC Name: [(2S)-2-(3-butoxy-4-methoxyphenyl)-2-hydroxyethyl]-methylazanium Traditional Name: [(2S)-2-(3-butoxy-4-methoxy-phenyl)-2-hydroxy-ethyl]-methyl-ammonium Formula: C14H24NO3+ MolecularWeight: 254.34526

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H23NO3/c1-4-5-8-18-14-9-11(12(16)10-15-2)6-7-13(14)17-3/h6-7,9,12,15-16H,4-5,8,10H2,1-3H3/p+1/t12-/m1/s1