ethyl 2-[[10,10-bis(oxidanylidene)-9H-thioxanthen-9-yl]imino]-2-(4-nitrophenyl)ethanoate

Systemtic Name: ethyl 2-[[10,10-bis(oxidanylidene)-9H-thioxanthen-9-yl]imino]-2-(4-nitrophenyl)ethanoate Openeye Name: ethyl 2-[(10,10-dioxo-9H-thioxanthen-9-yl)imino]-2-(4-nitrophenyl)acetate CAS Name: 2-[(10,10-dioxo-9H-thioxanthen-9-yl)imino]-2-(4-nitrophenyl)acetic acid ethyl ester IUPAC Name: ethyl 2-[(10,10-dioxo-9H-thioxanthen-9-yl)imino]-2-(4-nitrophenyl)acetate Traditional Name: 2-[(10,10-diketo-9H-thioxanthen-9-yl)imino]-2-(4-nitrophenyl)acetic acid ethyl ester Formula: C23H18N2O6S MolecularWeight: 450.46382

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=NC1C2=CC=CC=C2S(=O)(=O)C3=CC=CC=C13)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C(=NC1C2=CC=CC=C2S(=O)(=O)C3=CC=CC=C13)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C23H18N2O6S/c1-2-31-23(26)21(15-11-13-16(14-12-15)25(27)28)24-22-17-7-3-5-9-19(17)32(29,30)20-10-6-4-8-18(20)22/h3-14,22H,2H2,1H3