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

Systemtic Name: (4-methylphenyl) 3-[[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]amino]propanoate Openeye Name: p-tolyl 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-methylphenyl) ester IUPAC Name: (4-methylphenyl) 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 p-tolyl ester Formula: C17H16N2O4S MolecularWeight: 344.38494

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OC(=O)CCNC2=NS(=O)(=O)C3=CC=CC=C32

Isomeric SMILES

CC1=CC=C(C=C1)OC(=O)CCNC2=NS(=O)(=O)C3=CC=CC=C32

InChI

InChI=1S/C17H16N2O4S/c1-12-6-8-13(9-7-12)23-16(20)10-11-18-17-14-4-2-3-5-15(14)24(21,22)19-17/h2-9H,10-11H2,1H3,(H,18,19)