[2-[(3,5-dimethylphenyl)amino]-2-oxidanylidene-ethyl] anthracene-9-carboxylate

Systemtic Name: [2-[(3,5-dimethylphenyl)amino]-2-oxidanylidene-ethyl] anthracene-9-carboxylate Openeye Name: [2-(3,5-dimethylanilino)-2-oxo-ethyl] anthracene-9-carboxylate CAS Name: 9-anthracenecarboxylic acid [2-(3,5-dimethylanilino)-2-oxoethyl] ester IUPAC Name: [2-(3,5-dimethylanilino)-2-oxoethyl] anthracene-9-carboxylate Traditional Name: anthracene-9-carboxylic acid [2-(3,5-dimethylanilino)-2-keto-ethyl] ester Formula: C25H21NO3 MolecularWeight: 383.43914

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)NC(=O)COC(=O)C2=C3C=CC=CC3=CC4=CC=CC=C42)C

Isomeric SMILES

CC1=CC(=CC(=C1)NC(=O)COC(=O)C2=C3C=CC=CC3=CC4=CC=CC=C42)C

InChI

InChI=1S/C25H21NO3/c1-16-11-17(2)13-20(12-16)26-23(27)15-29-25(28)24-21-9-5-3-7-18(21)14-19-8-4-6-10-22(19)24/h3-14H,15H2,1-2H3,(H,26,27)