(3-methoxyphenyl)methyl-methyl-[(2S)-2-oxidanyl-3-(thiophen-2-ylmethoxy)propyl]azanium

Systemtic Name: (3-methoxyphenyl)methyl-methyl-[(2S)-2-oxidanyl-3-(thiophen-2-ylmethoxy)propyl]azanium Openeye Name: [(2S)-2-hydroxy-3-(2-thienylmethoxy)propyl]-[(3-methoxyphenyl)methyl]-methyl-ammonium CAS Name: [(2S)-2-hydroxy-3-(thiophen-2-ylmethoxy)propyl]-[(3-methoxyphenyl)methyl]-methylammonium IUPAC Name: [(2S)-2-hydroxy-3-(thiophen-2-ylmethoxy)propyl]-[(3-methoxyphenyl)methyl]-methylazanium Traditional Name: [(2S)-2-hydroxy-3-(2-thenyloxy)propyl]-m-anisyl-methyl-ammonium Formula: C17H24NO3S+ MolecularWeight: 322.44236

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC(=CC=C1)OC)CC(COCC2=CC=CS2)O

Isomeric SMILES

C[NH+](CC1=CC(=CC=C1)OC)C[C@@H](COCC2=CC=CS2)O

InChI

InChI=1S/C17H23NO3S/c1-18(10-14-5-3-6-16(9-14)20-2)11-15(19)12-21-13-17-7-4-8-22-17/h3-9,15,19H,10-13H2,1-2H3/p+1/t15-/m0/s1