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

Systemtic Name: (3S,4S)-1-[(2-methyl-1-benzothiophen-3-yl)methyl]-4-morpholin-4-yl-pyrrolidin-1-ium-3-ol Openeye Name: (3S,4S)-1-[(2-methylbenzothiophen-3-yl)methyl]-4-morpholino-pyrrolidin-1-ium-3-ol CAS Name: (3S,4S)-1-[(2-methyl-1-benzothiophen-3-yl)methyl]-4-(4-morpholinyl)-3-pyrrolidin-1-iumol IUPAC Name: (3S,4S)-1-[(2-methyl-1-benzothiophen-3-yl)methyl]-4-morpholin-4-ylpyrrolidin-1-ium-3-ol Traditional Name: (3S,4S)-1-[(2-methylbenzothiophen-3-yl)methyl]-4-morpholino-pyrrolidin-1-ium-3-ol Formula: C18H25N2O2S+ MolecularWeight: 333.4683

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC=CC=C2S1)C[NH+]3CC(C(C3)O)N4CCOCC4

Isomeric SMILES

CC1=C(C2=CC=CC=C2S1)C[NH+]3C[C@@H]([C@H](C3)O)N4CCOCC4

InChI

InChI=1S/C18H24N2O2S/c1-13-15(14-4-2-3-5-18(14)23-13)10-19-11-16(17(21)12-19)20-6-8-22-9-7-20/h2-5,16-17,21H,6-12H2,1H3/p+1/t16-,17-/m0/s1