[2-oxidanylidene-2-(2,3,4,5-tetramethylphenyl)ethyl] 3-(3-oxidanylidene-1,4-benzothiazin-4-yl)propanoate

Systemtic Name: [2-oxidanylidene-2-(2,3,4,5-tetramethylphenyl)ethyl] 3-(3-oxidanylidene-1,4-benzothiazin-4-yl)propanoate Openeye Name: [2-oxo-2-(2,3,4,5-tetramethylphenyl)ethyl] 3-(3-oxo-1,4-benzothiazin-4-yl)propanoate CAS Name: 3-(3-oxo-1,4-benzothiazin-4-yl)propanoic acid [2-oxo-2-(2,3,4,5-tetramethylphenyl)ethyl] ester IUPAC Name: [2-oxo-2-(2,3,4,5-tetramethylphenyl)ethyl] 3-(3-oxo-1,4-benzothiazin-4-yl)propanoate Traditional Name: 3-(3-keto-1,4-benzothiazin-4-yl)propionic acid [2-keto-2-(2,3,4,5-tetramethylphenyl)ethyl] ester Formula: C23H25NO4S MolecularWeight: 411.5139

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C(=C1)C(=O)COC(=O)CCN2C(=O)CSC3=CC=CC=C32)C)C)C

Isomeric SMILES

CC1=C(C(=C(C(=C1)C(=O)COC(=O)CCN2C(=O)CSC3=CC=CC=C32)C)C)C

InChI

InChI=1S/C23H25NO4S/c1-14-11-18(17(4)16(3)15(14)2)20(25)12-28-23(27)9-10-24-19-7-5-6-8-21(19)29-13-22(24)26/h5-8,11H,9-10,12-13H2,1-4H3