[4-[(2-methoxyphenyl)carbonylamino]phenyl] 3-(3-oxidanylidene-1,4-benzothiazin-4-yl)propanoate

Systemtic Name: [4-[(2-methoxyphenyl)carbonylamino]phenyl] 3-(3-oxidanylidene-1,4-benzothiazin-4-yl)propanoate Openeye Name: [4-[(2-methoxybenzoyl)amino]phenyl] 3-(3-oxo-1,4-benzothiazin-4-yl)propanoate CAS Name: 3-(3-oxo-1,4-benzothiazin-4-yl)propanoic acid [4-[[(2-methoxyphenyl)-oxomethyl]amino]phenyl] ester IUPAC Name: [4-[(2-methoxybenzoyl)amino]phenyl] 3-(3-oxo-1,4-benzothiazin-4-yl)propanoate Traditional Name: 3-(3-keto-1,4-benzothiazin-4-yl)propionic acid [4-(o-anisoylamino)phenyl] ester Formula: C25H22N2O5S MolecularWeight: 462.51758

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C(=O)NC2=CC=C(C=C2)OC(=O)CCN3C(=O)CSC4=CC=CC=C43

Isomeric SMILES

COC1=CC=CC=C1C(=O)NC2=CC=C(C=C2)OC(=O)CCN3C(=O)CSC4=CC=CC=C43

InChI

InChI=1S/C25H22N2O5S/c1-31-21-8-4-2-6-19(21)25(30)26-17-10-12-18(13-11-17)32-24(29)14-15-27-20-7-3-5-9-22(20)33-16-23(27)28/h2-13H,14-16H2,1H3,(H,26,30)