pentyl 5,8-bis[(4-chlorophenyl)sulfanyl]-9,10-bis(oxidanylidene)anthracene-2-carboxylate

Systemtic Name: pentyl 5,8-bis[(4-chlorophenyl)sulfanyl]-9,10-bis(oxidanylidene)anthracene-2-carboxylate Openeye Name: pentyl 5,8-bis[(4-chlorophenyl)sulfanyl]-9,10-dioxo-anthracene-2-carboxylate CAS Name: 5,8-bis[(4-chlorophenyl)thio]-9,10-dioxo-2-anthracenecarboxylic acid pentyl ester IUPAC Name: pentyl 5,8-bis[(4-chlorophenyl)sulfanyl]-9,10-dioxoanthracene-2-carboxylate Traditional Name: 5,8-bis[(4-chlorophenyl)thio]-9,10-diketo-anthracene-2-carboxylic acid amyl ester Formula: C32H24Cl2O4S2 MolecularWeight: 607.56656

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC(=O)C1=CC2=C(C=C1)C(=O)C3=C(C=CC(=C3C2=O)SC4=CC=C(C=C4)Cl)SC5=CC=C(C=C5)Cl

Isomeric SMILES

CCCCCOC(=O)C1=CC2=C(C=C1)C(=O)C3=C(C=CC(=C3C2=O)SC4=CC=C(C=C4)Cl)SC5=CC=C(C=C5)Cl

InChI

InChI=1S/C32H24Cl2O4S2/c1-2-3-4-17-38-32(37)19-5-14-24-25(18-19)31(36)29-27(40-23-12-8-21(34)9-13-23)16-15-26(28(29)30(24)35)39-22-10-6-20(33)7-11-22/h5-16,18H,2-4,17H2,1H3