ethyl 1-[[(2Z)-3-oxidanylidene-2-(phenylmethylidene)-4H-1,4-benzothiazin-6-yl]carbonyl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[[(2Z)-3-oxidanylidene-2-(phenylmethylidene)-4H-1,4-benzothiazin-6-yl]carbonyl]piperidine-4-carboxylate Openeye Name: ethyl 1-[(2Z)-2-benzylidene-3-oxo-4H-1,4-benzothiazine-6-carbonyl]piperidine-4-carboxylate CAS Name: 1-[oxo-[(2Z)-3-oxo-2-(phenylmethylene)-4H-1,4-benzothiazin-6-yl]methyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[(2Z)-2-benzylidene-3-oxo-4H-1,4-benzothiazine-6-carbonyl]piperidine-4-carboxylate Traditional Name: 1-[(2Z)-2-benzal-3-keto-4H-1,4-benzothiazine-6-carbonyl]isonipecotic acid ethyl ester Formula: C24H24N2O4S MolecularWeight: 436.52336

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C(=O)C2=CC3=C(C=C2)SC(=CC4=CC=CC=C4)C(=O)N3

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C(=O)C2=CC3=C(C=C2)S/C(=C\C4=CC=CC=C4)/C(=O)N3

InChI

InChI=1S/C24H24N2O4S/c1-2-30-24(29)17-10-12-26(13-11-17)23(28)18-8-9-20-19(15-18)25-22(27)21(31-20)14-16-6-4-3-5-7-16/h3-9,14-15,17H,2,10-13H2,1H3,(H,25,27)/b21-14-