[2-(3-nitrophenyl)-2-oxidanylidene-ethyl] 4-[2-(3-oxidanylidene-4H-1,4-benzothiazin-2-yl)ethanoylamino]benzoate

Systemtic Name: [2-(3-nitrophenyl)-2-oxidanylidene-ethyl] 4-[2-(3-oxidanylidene-4H-1,4-benzothiazin-2-yl)ethanoylamino]benzoate Openeye Name: [2-(3-nitrophenyl)-2-oxo-ethyl] 4-[[2-(3-oxo-4H-1,4-benzothiazin-2-yl)acetyl]amino]benzoate CAS Name: 4-[[1-oxo-2-(3-oxo-4H-1,4-benzothiazin-2-yl)ethyl]amino]benzoic acid [2-(3-nitrophenyl)-2-oxoethyl] ester IUPAC Name: [2-(3-nitrophenyl)-2-oxoethyl] 4-[[2-(3-oxo-4H-1,4-benzothiazin-2-yl)acetyl]amino]benzoate Traditional Name: 4-[[2-(3-keto-4H-1,4-benzothiazin-2-yl)acetyl]amino]benzoic acid [2-keto-2-(3-nitrophenyl)ethyl] ester Formula: C25H19N3O7S MolecularWeight: 505.49926

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=O)C(S2)CC(=O)NC3=CC=C(C=C3)C(=O)OCC(=O)C4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)NC(=O)C(S2)CC(=O)NC3=CC=C(C=C3)C(=O)OCC(=O)C4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C25H19N3O7S/c29-20(16-4-3-5-18(12-16)28(33)34)14-35-25(32)15-8-10-17(11-9-15)26-23(30)13-22-24(31)27-19-6-1-2-7-21(19)36-22/h1-12,22H,13-14H2,(H,26,30)(H,27,31)