[2-butyl-1,1-bis(oxidanylidene)-1$l^{6},2-benzothiazin-4-yl] 2-acetyloxybenzoate

Systemtic Name: [2-butyl-1,1-bis(oxidanylidene)-1$l^{6},2-benzothiazin-4-yl] 2-acetyloxybenzoate Openeye Name: (2-butyl-1,1-dioxo-1$l^{6},2-benzothiazin-4-yl) 2-acetoxybenzoate CAS Name: 2-acetyloxybenzoic acid (2-butyl-1,1-dioxo-1$l^{6},2-benzothiazin-4-yl) ester IUPAC Name: (2-butyl-1,1-dioxo-1$l^{6},2-benzothiazin-4-yl) 2-acetyloxybenzoate Traditional Name: 2-acetoxybenzoic acid (2-butyl-1,1-diketo-1$l^{6},2-benzothiazin-4-yl) ester Formula: C21H21NO6S MolecularWeight: 415.45954

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C=C(C2=CC=CC=C2S1(=O)=O)OC(=O)C3=CC=CC=C3OC(=O)C

Isomeric SMILES

CCCCN1C=C(C2=CC=CC=C2S1(=O)=O)OC(=O)C3=CC=CC=C3OC(=O)C

InChI

InChI=1S/C21H21NO6S/c1-3-4-13-22-14-19(16-9-6-8-12-20(16)29(22,25)26)28-21(24)17-10-5-7-11-18(17)27-15(2)23/h5-12,14H,3-4,13H2,1-2H3