N-(4-ethoxyphenyl)-4-[1,1,3-tris(oxidanylidene)-1,2-benzothiazol-2-yl]benzamide

Systemtic Name: N-(4-ethoxyphenyl)-4-[1,1,3-tris(oxidanylidene)-1,2-benzothiazol-2-yl]benzamide Openeye Name: N-(4-ethoxyphenyl)-4-(1,1,3-trioxo-1,2-benzothiazol-2-yl)benzamide CAS Name: N-(4-ethoxyphenyl)-4-(1,1,3-trioxo-1,2-benzothiazol-2-yl)benzamide IUPAC Name: N-(4-ethoxyphenyl)-4-(1,1,3-trioxo-1,2-benzothiazol-2-yl)benzamide Traditional Name: N-p-phenetyl-4-(1,1,3-triketo-1,2-benzothiazol-2-yl)benzamide Formula: C22H18N2O5S MolecularWeight: 422.45372

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)N3C(=O)C4=CC=CC=C4S3(=O)=O

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)N3C(=O)C4=CC=CC=C4S3(=O)=O

InChI

InChI=1S/C22H18N2O5S/c1-2-29-18-13-9-16(10-14-18)23-21(25)15-7-11-17(12-8-15)24-22(26)19-5-3-4-6-20(19)30(24,27)28/h3-14H,2H2,1H3,(H,23,25)