[2-chloranyl-5-oxidanyl-9,10-bis(oxidanylidene)-6-phenylsulfanyl-anthracen-1-yl] ethanoate

Systemtic Name: [2-chloranyl-5-oxidanyl-9,10-bis(oxidanylidene)-6-phenylsulfanyl-anthracen-1-yl] ethanoate Openeye Name: (2-chloro-5-hydroxy-9,10-dioxo-6-phenylsulfanyl-1-anthryl) acetate CAS Name: acetic acid [2-chloro-5-hydroxy-9,10-dioxo-6-(phenylthio)-1-anthracenyl] ester IUPAC Name: (2-chloro-5-hydroxy-9,10-dioxo-6-phenylsulfanylanthracen-1-yl) acetate Traditional Name: acetic acid [2-chloro-5-hydroxy-9,10-diketo-6-(phenylthio)-1-anthryl] ester Formula: C22H13ClO5S MolecularWeight: 424.85362

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=C(C=CC2=C1C(=O)C3=C(C2=O)C(=C(C=C3)SC4=CC=CC=C4)O)Cl

Isomeric SMILES

CC(=O)OC1=C(C=CC2=C1C(=O)C3=C(C2=O)C(=C(C=C3)SC4=CC=CC=C4)O)Cl

InChI

InChI=1S/C22H13ClO5S/c1-11(24)28-22-15(23)9-7-14-18(22)20(26)13-8-10-16(21(27)17(13)19(14)25)29-12-5-3-2-4-6-12/h2-10,27H,1H3