(phenylmethyl) 2-(6-aminopurin-9-yl)aziridine-2-carboxylate

Systemtic Name: (phenylmethyl) 2-(6-aminopurin-9-yl)aziridine-2-carboxylate Openeye Name: benzyl 2-(6-aminopurin-9-yl)aziridine-2-carboxylate CAS Name: 2-(6-aminopurin-9-yl)-2-aziridinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 2-(6-aminopurin-9-yl)aziridine-2-carboxylate Traditional Name: 2-adenin-9-ylethylenimine-2-carboxylic acid benzyl ester Formula: C15H14N6O2 MolecularWeight: 310.31066

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Descriptors Computed from Structure

Canonical SMILES:

C1C(N1)(C(=O)OCC2=CC=CC=C2)N3C=NC4=C3N=CN=C4N

Isomeric SMILES

C1C(N1)(C(=O)OCC2=CC=CC=C2)N3C=NC4=C3N=CN=C4N

InChI

InChI=1S/C15H14N6O2/c16-12-11-13(18-8-17-12)21(9-19-11)15(7-20-15)14(22)23-6-10-4-2-1-3-5-10/h1-5,8-9,20H,6-7H2,(H2,16,17,18)