ethyl 2-[2-azanyl-6-(phenylmethoxycarbonylamino)purin-9-yl]ethanoate

Systemtic Name: ethyl 2-[2-azanyl-6-(phenylmethoxycarbonylamino)purin-9-yl]ethanoate Openeye Name: ethyl 2-[2-amino-6-(benzyloxycarbonylamino)purin-9-yl]acetate CAS Name: 2-[2-amino-6-(phenylmethoxycarbonylamino)-9-purinyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[2-amino-6-(phenylmethoxycarbonylamino)purin-9-yl]acetate Traditional Name: 2-[2-amino-6-(benzyloxycarbonylamino)purin-9-yl]acetic acid ethyl ester Formula: C17H18N6O4 MolecularWeight: 370.36262

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1C=NC2=C1N=C(N=C2NC(=O)OCC3=CC=CC=C3)N

Isomeric SMILES

CCOC(=O)CN1C=NC2=C1N=C(N=C2NC(=O)OCC3=CC=CC=C3)N

InChI

InChI=1S/C17H18N6O4/c1-2-26-12(24)8-23-10-19-13-14(20-16(18)22-15(13)23)21-17(25)27-9-11-6-4-3-5-7-11/h3-7,10H,2,8-9H2,1H3,(H3,18,20,21,22,25)