(3S)-N-(6-methyl-1,3-benzothiazol-2-yl)piperidin-1-ium-3-carboxamide

Systemtic Name: (3S)-N-(6-methyl-1,3-benzothiazol-2-yl)piperidin-1-ium-3-carboxamide Openeye Name: (3S)-N-(6-methyl-1,3-benzothiazol-2-yl)piperidin-1-ium-3-carboxamide CAS Name: (3S)-N-(6-methyl-1,3-benzothiazol-2-yl)-3-piperidin-1-iumcarboxamide IUPAC Name: (3S)-N-(6-methyl-1,3-benzothiazol-2-yl)piperidin-1-ium-3-carboxamide Traditional Name: (3S)-N-(6-methyl-1,3-benzothiazol-2-yl)piperidin-1-ium-3-carboxamide Formula: C14H18N3OS+ MolecularWeight: 276.37722

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(S2)NC(=O)C3CCC[NH2+]C3

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(S2)NC(=O)[C@H]3CCC[NH2+]C3

InChI

InChI=1S/C14H17N3OS/c1-9-4-5-11-12(7-9)19-14(16-11)17-13(18)10-3-2-6-15-8-10/h4-5,7,10,15H,2-3,6,8H2,1H3,(H,16,17,18)/p+1/t10-/m0/s1