4-[4-(1,3-benzothiazol-2-yl)piperidin-1-yl]-4-oxidanylidene-butanoate

Systemtic Name: 4-[4-(1,3-benzothiazol-2-yl)piperidin-1-yl]-4-oxidanylidene-butanoate Openeye Name: 4-[4-(1,3-benzothiazol-2-yl)-1-piperidyl]-4-oxo-butanoate CAS Name: 4-[4-(1,3-benzothiazol-2-yl)-1-piperidinyl]-4-oxobutanoate IUPAC Name: 4-[4-(1,3-benzothiazol-2-yl)piperidin-1-yl]-4-oxobutanoate Traditional Name: 4-[4-(1,3-benzothiazol-2-yl)piperidino]-4-keto-butyrate Formula: C16H17N2O3S- MolecularWeight: 317.38278

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C2=NC3=CC=CC=C3S2)C(=O)CCC(=O)[O-]

Isomeric SMILES

C1CN(CCC1C2=NC3=CC=CC=C3S2)C(=O)CCC(=O)[O-]

InChI

InChI=1S/C16H18N2O3S/c19-14(5-6-15(20)21)18-9-7-11(8-10-18)16-17-12-3-1-2-4-13(12)22-16/h1-4,11H,5-10H2,(H,20,21)/p-1