[3-acetamido-5-(acridin-9-ylamino)phenyl]methyl 3-oxidanylidenebutanoate

Systemtic Name: [3-acetamido-5-(acridin-9-ylamino)phenyl]methyl 3-oxidanylidenebutanoate Openeye Name: [3-acetamido-5-(acridin-9-ylamino)phenyl]methyl 3-oxobutanoate CAS Name: 3-oxobutanoic acid [3-acetamido-5-(9-acridinylamino)phenyl]methyl ester IUPAC Name: [3-acetamido-5-(acridin-9-ylamino)phenyl]methyl 3-oxobutanoate Traditional Name: 3-ketobutyric acid [3-acetamido-5-(acridin-9-ylamino)benzyl] ester Formula: C26H23N3O4 MolecularWeight: 441.47852

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CC(=O)OCC1=CC(=CC(=C1)NC(=O)C)NC2=C3C=CC=CC3=NC4=CC=CC=C42

Isomeric SMILES

CC(=O)CC(=O)OCC1=CC(=CC(=C1)NC(=O)C)NC2=C3C=CC=CC3=NC4=CC=CC=C42

InChI

InChI=1S/C26H23N3O4/c1-16(30)11-25(32)33-15-18-12-19(27-17(2)31)14-20(13-18)28-26-21-7-3-5-9-23(21)29-24-10-6-4-8-22(24)26/h3-10,12-14H,11,15H2,1-2H3,(H,27,31)(H,28,29)