2-azanyl-9-[2-methylidene-4-oxidanyl-3-(phenylmethoxymethyl)cyclopentyl]-3H-purin-6-one

Systemtic Name: 2-azanyl-9-[2-methylidene-4-oxidanyl-3-(phenylmethoxymethyl)cyclopentyl]-3H-purin-6-one Openeye Name: 2-amino-9-[3-(benzyloxymethyl)-4-hydroxy-2-methylene-cyclopentyl]-3H-purin-6-one CAS Name: 2-amino-9-[4-hydroxy-2-methylene-3-(phenylmethoxymethyl)cyclopentyl]-3H-purin-6-one IUPAC Name: 2-amino-9-[4-hydroxy-2-methylidene-3-(phenylmethoxymethyl)cyclopentyl]-3H-purin-6-one Traditional Name: 2-amino-9-[3-(benzoxymethyl)-4-hydroxy-2-methylene-cyclopentyl]-3H-purin-6-one Formula: C19H21N5O3 MolecularWeight: 367.40174

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=C1C(CC(C1COCC2=CC=CC=C2)O)N3C=NC4=C3NC(=NC4=O)N

Isomeric SMILES

C=C1C(CC(C1COCC2=CC=CC=C2)O)N3C=NC4=C3NC(=NC4=O)N

InChI

InChI=1S/C19H21N5O3/c1-11-13(9-27-8-12-5-3-2-4-6-12)15(25)7-14(11)24-10-21-16-17(24)22-19(20)23-18(16)26/h2-6,10,13-15,25H,1,7-9H2,(H3,20,22,23,26)