[2-oxidanylidene-2-[4-(propanoylamino)phenyl]ethyl] anthracene-9-carboxylate

Systemtic Name: [2-oxidanylidene-2-[4-(propanoylamino)phenyl]ethyl] anthracene-9-carboxylate Openeye Name: [2-oxo-2-[4-(propanoylamino)phenyl]ethyl] anthracene-9-carboxylate CAS Name: 9-anthracenecarboxylic acid [2-oxo-2-[4-(1-oxopropylamino)phenyl]ethyl] ester IUPAC Name: [2-oxo-2-[4-(propanoylamino)phenyl]ethyl] anthracene-9-carboxylate Traditional Name: anthracene-9-carboxylic acid [2-keto-2-(4-propionamidophenyl)ethyl] ester Formula: C26H21NO4 MolecularWeight: 411.44924

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=CC=C(C=C1)C(=O)COC(=O)C2=C3C=CC=CC3=CC4=CC=CC=C42

Isomeric SMILES

CCC(=O)NC1=CC=C(C=C1)C(=O)COC(=O)C2=C3C=CC=CC3=CC4=CC=CC=C42

InChI

InChI=1S/C26H21NO4/c1-2-24(29)27-20-13-11-17(12-14-20)23(28)16-31-26(30)25-21-9-5-3-7-18(21)15-19-8-4-6-10-22(19)25/h3-15H,2,16H2,1H3,(H,27,29)