(3S,4S)-4-morpholin-4-yl-1-[[4-(3-oxidanylprop-1-ynyl)thiophen-2-yl]methyl]pyrrolidin-1-ium-3-ol

Systemtic Name: (3S,4S)-4-morpholin-4-yl-1-[[4-(3-oxidanylprop-1-ynyl)thiophen-2-yl]methyl]pyrrolidin-1-ium-3-ol Openeye Name: (3S,4S)-1-[[4-(3-hydroxyprop-1-ynyl)-2-thienyl]methyl]-4-morpholino-pyrrolidin-1-ium-3-ol CAS Name: (3S,4S)-1-[[4-(3-hydroxyprop-1-ynyl)-2-thiophenyl]methyl]-4-(4-morpholinyl)-3-pyrrolidin-1-iumol IUPAC Name: (3S,4S)-1-[[4-(3-hydroxyprop-1-ynyl)thiophen-2-yl]methyl]-4-morpholin-4-ylpyrrolidin-1-ium-3-ol Traditional Name: (3S,4S)-1-[[4-(3-hydroxyprop-1-ynyl)-2-thienyl]methyl]-4-morpholino-pyrrolidin-1-ium-3-ol Formula: C16H23N2O3S+ MolecularWeight: 323.43042

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2C[NH+](CC2O)CC3=CC(=CS3)C#CCO

Isomeric SMILES

C1COCCN1[C@H]2C[NH+](C[C@@H]2O)CC3=CC(=CS3)C#CCO

InChI

InChI=1S/C16H22N2O3S/c19-5-1-2-13-8-14(22-12-13)9-17-10-15(16(20)11-17)18-3-6-21-7-4-18/h8,12,15-16,19-20H,3-7,9-11H2/p+1/t15-,16-/m0/s1