6-[(2R)-2-aminocarbonylpyrrolidin-1-yl]-2-phenyl-7H-purine-8-carboxylic acid

Systemtic Name: 6-[(2R)-2-aminocarbonylpyrrolidin-1-yl]-2-phenyl-7H-purine-8-carboxylic acid Openeye Name: 6-[(2R)-2-carbamoylpyrrolidin-1-yl]-2-phenyl-7H-purine-8-carboxylic acid CAS Name: 6-[(2R)-2-carbamoyl-1-pyrrolidinyl]-2-phenyl-7H-purine-8-carboxylic acid IUPAC Name: 6-[(2R)-2-carbamoylpyrrolidin-1-yl]-2-phenyl-7H-purine-8-carboxylic acid Traditional Name: 6-[(2R)-2-carbamoylpyrrolidino]-2-phenyl-7H-purine-8-carboxylic acid Formula: C17H16N6O3 MolecularWeight: 352.34734

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C2=NC(=NC3=C2NC(=N3)C(=O)O)C4=CC=CC=C4)C(=O)N

Isomeric SMILES

C1C[C@@H](N(C1)C2=NC(=NC3=C2NC(=N3)C(=O)O)C4=CC=CC=C4)C(=O)N

InChI

InChI=1S/C17H16N6O3/c18-12(24)10-7-4-8-23(10)16-11-14(21-15(19-11)17(25)26)20-13(22-16)9-5-2-1-3-6-9/h1-3,5-6,10H,4,7-8H2,(H2,18,24)(H,25,26)(H,19,20,21,22)/t10-/m1/s1