[(3S)-1-(1,3-benzothiazol-2-ylmethyl)piperidin-1-ium-3-yl]-morpholin-4-yl-methanone

Systemtic Name: [(3S)-1-(1,3-benzothiazol-2-ylmethyl)piperidin-1-ium-3-yl]-morpholin-4-yl-methanone Openeye Name: [(3S)-1-(1,3-benzothiazol-2-ylmethyl)piperidin-1-ium-3-yl]-morpholino-methanone CAS Name: [(3S)-1-(1,3-benzothiazol-2-ylmethyl)-3-piperidin-1-iumyl]-(4-morpholinyl)methanone IUPAC Name: [(3S)-1-(1,3-benzothiazol-2-ylmethyl)piperidin-1-ium-3-yl]-morpholin-4-ylmethanone Traditional Name: [(3S)-1-(1,3-benzothiazol-2-ylmethyl)piperidin-1-ium-3-yl]-morpholino-methanone Formula: C18H24N3O2S+ MolecularWeight: 346.46706

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C[NH+](C1)CC2=NC3=CC=CC=C3S2)C(=O)N4CCOCC4

Isomeric SMILES

C1C[C@@H](C[NH+](C1)CC2=NC3=CC=CC=C3S2)C(=O)N4CCOCC4

InChI

InChI=1S/C18H23N3O2S/c22-18(21-8-10-23-11-9-21)14-4-3-7-20(12-14)13-17-19-15-5-1-2-6-16(15)24-17/h1-2,5-6,14H,3-4,7-13H2/p+1/t14-/m0/s1