(E)-4-[4-(1,3-benzothiazol-2-yl)piperidin-1-yl]-4-oxidanylidene-but-2-enoate

Systemtic Name: (E)-4-[4-(1,3-benzothiazol-2-yl)piperidin-1-yl]-4-oxidanylidene-but-2-enoate Openeye Name: (E)-4-[4-(1,3-benzothiazol-2-yl)-1-piperidyl]-4-oxo-but-2-enoate CAS Name: (E)-4-[4-(1,3-benzothiazol-2-yl)-1-piperidinyl]-4-oxo-2-butenoate IUPAC Name: (E)-4-[4-(1,3-benzothiazol-2-yl)piperidin-1-yl]-4-oxobut-2-enoate Traditional Name: (E)-4-[4-(1,3-benzothiazol-2-yl)piperidino]-4-keto-but-2-enoate Formula: C16H15N2O3S- MolecularWeight: 315.3669

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H16N2O3S/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/h1-6,11H,7-10H2,(H,20,21)/p-1/b6-5+