[(2R)-1-oxidanylidene-1-(7H-purin-6-ylamino)propan-2-yl] anthracene-9-carboxylate

Systemtic Name: [(2R)-1-oxidanylidene-1-(7H-purin-6-ylamino)propan-2-yl] anthracene-9-carboxylate Openeye Name: [(1R)-1-methyl-2-oxo-2-(7H-purin-6-ylamino)ethyl] anthracene-9-carboxylate CAS Name: 9-anthracenecarboxylic acid [(2R)-1-oxo-1-(7H-purin-6-ylamino)propan-2-yl] ester IUPAC Name: [(2R)-1-oxo-1-(7H-purin-6-ylamino)propan-2-yl] anthracene-9-carboxylate Traditional Name: anthracene-9-carboxylic acid [(1R)-2-keto-1-methyl-2-(7H-purin-6-ylamino)ethyl] ester Formula: C23H17N5O3 MolecularWeight: 411.41278

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=NC=NC2=C1NC=N2)OC(=O)C3=C4C=CC=CC4=CC5=CC=CC=C53

Isomeric SMILES

C[C@H](C(=O)NC1=NC=NC2=C1NC=N2)OC(=O)C3=C4C=CC=CC4=CC5=CC=CC=C53

InChI

InChI=1S/C23H17N5O3/c1-13(22(29)28-21-19-20(25-11-24-19)26-12-27-21)31-23(30)18-16-8-4-2-6-14(16)10-15-7-3-5-9-17(15)18/h2-13H,1H3,(H2,24,25,26,27,28,29)/t13-/m1/s1