(4-methyl-2-oxidanylidene-chromen-7-yl) 3-[[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]amino]propanoate

Systemtic Name: (4-methyl-2-oxidanylidene-chromen-7-yl) 3-[[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]amino]propanoate Openeye Name: (4-methyl-2-oxo-chromen-7-yl) 3-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]propanoate CAS Name: 3-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]propanoic acid (4-methyl-2-oxo-1-benzopyran-7-yl) ester IUPAC Name: (4-methyl-2-oxochromen-7-yl) 3-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]propanoate Traditional Name: 3-[(1,1-diketo-1,2-benzothiazol-3-yl)amino]propionic acid (2-keto-4-methyl-chromen-7-yl) ester Formula: C20H16N2O6S MolecularWeight: 412.41584

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)OC2=C1C=CC(=C2)OC(=O)CCNC3=NS(=O)(=O)C4=CC=CC=C43

Isomeric SMILES

CC1=CC(=O)OC2=C1C=CC(=C2)OC(=O)CCNC3=NS(=O)(=O)C4=CC=CC=C43

InChI

InChI=1S/C20H16N2O6S/c1-12-10-19(24)28-16-11-13(6-7-14(12)16)27-18(23)8-9-21-20-15-4-2-3-5-17(15)29(25,26)22-20/h2-7,10-11H,8-9H2,1H3,(H,21,22)