(4-oxidanylidene-4-thiophen-2-yl-butyl) 9,10-bis(oxidanylidene)anthracene-1-carboxylate

Systemtic Name: (4-oxidanylidene-4-thiophen-2-yl-butyl) 9,10-bis(oxidanylidene)anthracene-1-carboxylate Openeye Name: [4-oxo-4-(2-thienyl)butyl] 9,10-dioxoanthracene-1-carboxylate CAS Name: 9,10-dioxo-1-anthracenecarboxylic acid (4-oxo-4-thiophen-2-ylbutyl) ester IUPAC Name: (4-oxo-4-thiophen-2-ylbutyl) 9,10-dioxoanthracene-1-carboxylate Traditional Name: 9,10-diketoanthracene-1-carboxylic acid [4-keto-4-(2-thienyl)butyl] ester Formula: C23H16O5S MolecularWeight: 404.43514

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=CC=C3)C(=O)OCCCC(=O)C4=CC=CS4

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=CC=C3)C(=O)OCCCC(=O)C4=CC=CS4

InChI

InChI=1S/C23H16O5S/c24-18(19-11-5-13-29-19)10-4-12-28-23(27)17-9-3-8-16-20(17)22(26)15-7-2-1-6-14(15)21(16)25/h1-3,5-9,11,13H,4,10,12H2