[(6Z)-1-thiacyclodec-6-en-3,8-diyn-5-yl] 9,10-bis(oxidanylidene)anthracene-2-carboxylate

Systemtic Name: [(6Z)-1-thiacyclodec-6-en-3,8-diyn-5-yl] 9,10-bis(oxidanylidene)anthracene-2-carboxylate Openeye Name: [(6Z)-1-thiacyclodec-6-en-3,8-diyn-5-yl] 9,10-dioxoanthracene-2-carboxylate CAS Name: 9,10-dioxo-2-anthracenecarboxylic acid [(6Z)-1-thiacyclodec-6-en-3,8-diyn-5-yl] ester IUPAC Name: [(6Z)-1-thiacyclodec-6-en-3,8-diyn-5-yl] 9,10-dioxoanthracene-2-carboxylate Traditional Name: 9,10-diketoanthracene-2-carboxylic acid [(6Z)-1-thiacyclodec-6-en-3,8-diyn-5-yl] ester Formula: C24H14O4S MolecularWeight: 398.43056

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Descriptors Computed from Structure

Canonical SMILES:

C1C#CC=CC(C#CCS1)OC(=O)C2=CC3=C(C=C2)C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

C1C#C/C=C\C(C#CCS1)OC(=O)C2=CC3=C(C=C2)C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C24H14O4S/c25-22-18-9-3-4-10-19(18)23(26)21-15-16(11-12-20(21)22)24(27)28-17-7-2-1-5-13-29-14-6-8-17/h2-4,7,9-12,15,17H,13-14H2/b7-2-