furan-2-ylmethyl-[(2S)-3-(3-methylphenoxy)-2-oxidanyl-propyl]-(thiophen-2-ylmethyl)azanium

Systemtic Name: furan-2-ylmethyl-[(2S)-3-(3-methylphenoxy)-2-oxidanyl-propyl]-(thiophen-2-ylmethyl)azanium Openeye Name: 2-furylmethyl-[(2S)-2-hydroxy-3-(3-methylphenoxy)propyl]-(2-thienylmethyl)ammonium CAS Name: 2-furanylmethyl-[(2S)-2-hydroxy-3-(3-methylphenoxy)propyl]-(thiophen-2-ylmethyl)ammonium IUPAC Name: furan-2-ylmethyl-[(2S)-2-hydroxy-3-(3-methylphenoxy)propyl]-(thiophen-2-ylmethyl)azanium Traditional Name: 2-furfuryl-[(2S)-2-hydroxy-3-(3-methylphenoxy)propyl]-(2-thenyl)ammonium Formula: C20H24NO3S+ MolecularWeight: 358.47446

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCC(C[NH+](CC2=CC=CO2)CC3=CC=CS3)O

Isomeric SMILES

CC1=CC(=CC=C1)OC[C@H](C[NH+](CC2=CC=CO2)CC3=CC=CS3)O

InChI

InChI=1S/C20H23NO3S/c1-16-5-2-6-18(11-16)24-15-17(22)12-21(13-19-7-3-9-23-19)14-20-8-4-10-25-20/h2-11,17,22H,12-15H2,1H3/p+1/t17-/m0/s1