2-[[9,10,10-tris(oxidanylidene)thioxanthen-3-yl]carbonylamino]ethyl 4-methoxybenzoate

Systemtic Name: 2-[[9,10,10-tris(oxidanylidene)thioxanthen-3-yl]carbonylamino]ethyl 4-methoxybenzoate Openeye Name: 2-[(9,10,10-trioxothioxanthene-3-carbonyl)amino]ethyl 4-methoxybenzoate CAS Name: 4-methoxybenzoic acid 2-[[oxo-(9,10,10-trioxo-3-thioxanthenyl)methyl]amino]ethyl ester IUPAC Name: 2-[(9,10,10-trioxothioxanthene-3-carbonyl)amino]ethyl 4-methoxybenzoate Traditional Name: 4-methoxybenzoic acid 2-[(9,10,10-triketothioxanthene-3-carbonyl)amino]ethyl ester Formula: C24H19NO7S MolecularWeight: 465.47516

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)OCCNC(=O)C2=CC3=C(C=C2)C(=O)C4=CC=CC=C4S3(=O)=O

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)OCCNC(=O)C2=CC3=C(C=C2)C(=O)C4=CC=CC=C4S3(=O)=O

InChI

InChI=1S/C24H19NO7S/c1-31-17-9-6-15(7-10-17)24(28)32-13-12-25-23(27)16-8-11-19-21(14-16)33(29,30)20-5-3-2-4-18(20)22(19)26/h2-11,14H,12-13H2,1H3,(H,25,27)