3-[2-chloranyl-6-[(phenylmethyl)amino]purin-9-yl]propan-1-ol

Systemtic Name: 3-[2-chloranyl-6-[(phenylmethyl)amino]purin-9-yl]propan-1-ol Openeye Name: 3-[6-(benzylamino)-2-chloro-purin-9-yl]propan-1-ol CAS Name: 3-[2-chloro-6-[(phenylmethyl)amino]-9-purinyl]-1-propanol IUPAC Name: 3-[6-(benzylamino)-2-chloropurin-9-yl]propan-1-ol Traditional Name: 3-[6-(benzylamino)-2-chloro-purin-9-yl]propan-1-ol Formula: C15H16ClN5O MolecularWeight: 317.77344

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC2=NC(=NC3=C2N=CN3CCCO)Cl

Isomeric SMILES

C1=CC=C(C=C1)CNC2=NC(=NC3=C2N=CN3CCCO)Cl

InChI

InChI=1S/C15H16ClN5O/c16-15-19-13(17-9-11-5-2-1-3-6-11)12-14(20-15)21(10-18-12)7-4-8-22/h1-3,5-6,10,22H,4,7-9H2,(H,17,19,20)