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6-(6-aminopurin-9-yl)-2-(phenylmethoxycarbonylamino)hexanoic acid

6-(6-aminopurin-9-yl)-2-(phenylmethoxycarbonylamino)hexanoic acid

Systemtic Name:6-(6-aminopurin-9-yl)-2-(phenylmethoxycarbonylamino)hexanoic acid
Openeye Name:6-(6-aminopurin-9-yl)-2-(benzyloxycarbonylamino)hexanoic acid
CAS Name:6-(6-aminopurin-9-yl)-2-(phenylmethoxycarbonylamino)hexanoic acid
IUPAC Name:6-(6-aminopurin-9-yl)-2-(phenylmethoxycarbonylamino)hexanoic acid
Traditional Name:6-adenin-9-yl-2-(benzyloxycarbonylamino)hexanoic acid
Formula: C19H22N6O4
MolecularWeight: 398.41578
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)NC(CCCCN2C=NC3=C2N=CN=C3N)C(=O)O


Isomeric SMILES

C1=CC=C(C=C1)COC(=O)NC(CCCCN2C=NC3=C2N=CN=C3N)C(=O)O


InChI

InChI=1S/C19H22N6O4/c20-16-15-17(22-11-21-16)25(12-23-15)9-5-4-8-14(18(26)27)24-19(28)29-10-13-6-2-1-3-7-13/h1-3,6-7,11-12,14H,4-5,8-10H2,(H,24,28)(H,26,27)(H2,20,21,22)


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