(4-ethoxyphenyl)methyl-[(3-methylthiophen-2-yl)methyl]-[(2S)-2-oxidanylpropyl]azanium

Systemtic Name: (4-ethoxyphenyl)methyl-[(3-methylthiophen-2-yl)methyl]-[(2S)-2-oxidanylpropyl]azanium Openeye Name: (4-ethoxyphenyl)methyl-[(2S)-2-hydroxypropyl]-[(3-methyl-2-thienyl)methyl]ammonium CAS Name: (4-ethoxyphenyl)methyl-[(2S)-2-hydroxypropyl]-[(3-methyl-2-thiophenyl)methyl]ammonium IUPAC Name: (4-ethoxyphenyl)methyl-[(2S)-2-hydroxypropyl]-[(3-methylthiophen-2-yl)methyl]azanium Traditional Name: (4-ethoxybenzyl)-[(2S)-2-hydroxypropyl]-[(3-methyl-2-thienyl)methyl]ammonium Formula: C18H26NO2S+ MolecularWeight: 320.46954

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C[NH+](CC2=C(C=CS2)C)CC(C)O

Isomeric SMILES

CCOC1=CC=C(C=C1)C[NH+](CC2=C(C=CS2)C)C[C@H](C)O

InChI

InChI=1S/C18H25NO2S/c1-4-21-17-7-5-16(6-8-17)12-19(11-15(3)20)13-18-14(2)9-10-22-18/h5-10,15,20H,4,11-13H2,1-3H3/p+1/t15-/m0/s1