[3-ethanoyl-1,1-bis(oxidanylidene)-2-propan-2-yl-1$l^{6},2-benzothiazin-4-yl] 2-phenylethanoate

Systemtic Name: [3-ethanoyl-1,1-bis(oxidanylidene)-2-propan-2-yl-1$l^{6},2-benzothiazin-4-yl] 2-phenylethanoate Openeye Name: (3-acetyl-2-isopropyl-1,1-dioxo-1$l^{6},2-benzothiazin-4-yl) 2-phenylacetate CAS Name: 2-phenylacetic acid (3-acetyl-1,1-dioxo-2-propan-2-yl-1$l^{6},2-benzothiazin-4-yl) ester IUPAC Name: (3-acetyl-1,1-dioxo-2-propan-2-yl-1$l^{6},2-benzothiazin-4-yl) 2-phenylacetate Traditional Name: 2-phenylacetic acid (3-acetyl-2-isopropyl-1,1-diketo-1$l^{6},2-benzothiazin-4-yl) ester Formula: C21H21NO5S MolecularWeight: 399.46014

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C(=C(C2=CC=CC=C2S1(=O)=O)OC(=O)CC3=CC=CC=C3)C(=O)C

Isomeric SMILES

CC(C)N1C(=C(C2=CC=CC=C2S1(=O)=O)OC(=O)CC3=CC=CC=C3)C(=O)C

InChI

InChI=1S/C21H21NO5S/c1-14(2)22-20(15(3)23)21(17-11-7-8-12-18(17)28(22,25)26)27-19(24)13-16-9-5-4-6-10-16/h4-12,14H,13H2,1-3H3