methyl 4-methyl-3-[[9,10,10-tris(oxidanylidene)thioxanthen-3-yl]carbonylamino]benzoate

Systemtic Name: methyl 4-methyl-3-[[9,10,10-tris(oxidanylidene)thioxanthen-3-yl]carbonylamino]benzoate Openeye Name: methyl 4-methyl-3-[(9,10,10-trioxothioxanthene-3-carbonyl)amino]benzoate CAS Name: 4-methyl-3-[[oxo-(9,10,10-trioxo-3-thioxanthenyl)methyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-methyl-3-[(9,10,10-trioxothioxanthene-3-carbonyl)amino]benzoate Traditional Name: 4-methyl-3-[(9,10,10-triketothioxanthene-3-carbonyl)amino]benzoic acid methyl ester Formula: C23H17NO6S MolecularWeight: 435.44918

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)C2=CC3=C(C=C2)C(=O)C4=CC=CC=C4S3(=O)=O

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)C2=CC3=C(C=C2)C(=O)C4=CC=CC=C4S3(=O)=O

InChI

InChI=1S/C23H17NO6S/c1-13-7-8-15(23(27)30-2)11-18(13)24-22(26)14-9-10-17-20(12-14)31(28,29)19-6-4-3-5-16(19)21(17)25/h3-12H,1-2H3,(H,24,26)