methyl 2-[[10,10-bis(oxidanylidene)thioxanthen-9-ylidene]amino]-2-phenyl-ethanoate

Systemtic Name: methyl 2-[[10,10-bis(oxidanylidene)thioxanthen-9-ylidene]amino]-2-phenyl-ethanoate Openeye Name: methyl 2-[(10,10-dioxothioxanthen-9-ylidene)amino]-2-phenyl-acetate CAS Name: 2-[(10,10-dioxo-9-thioxanthenylidene)amino]-2-phenylacetic acid methyl ester IUPAC Name: methyl 2-[(10,10-dioxothioxanthen-9-ylidene)amino]-2-phenylacetate Traditional Name: 2-[(10,10-diketothioxanthen-9-ylidene)amino]-2-phenyl-acetic acid methyl ester Formula: C22H17NO4S MolecularWeight: 391.43968

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(C1=CC=CC=C1)N=C2C3=CC=CC=C3S(=O)(=O)C4=CC=CC=C42

Isomeric SMILES

COC(=O)C(C1=CC=CC=C1)N=C2C3=CC=CC=C3S(=O)(=O)C4=CC=CC=C42

InChI

InChI=1S/C22H17NO4S/c1-27-22(24)20(15-9-3-2-4-10-15)23-21-16-11-5-7-13-18(16)28(25,26)19-14-8-6-12-17(19)21/h2-14,20H,1H3