2-azanyl-9-[(1R,4S)-4-(hydroxymethyl)-4-(phenylmethyl)cyclopent-2-en-1-yl]-3H-purin-6-one

Systemtic Name: 2-azanyl-9-[(1R,4S)-4-(hydroxymethyl)-4-(phenylmethyl)cyclopent-2-en-1-yl]-3H-purin-6-one Openeye Name: 2-amino-9-[(1R,4S)-4-benzyl-4-(hydroxymethyl)cyclopent-2-en-1-yl]-3H-purin-6-one CAS Name: 2-amino-9-[(1R,4S)-4-(hydroxymethyl)-4-(phenylmethyl)-1-cyclopent-2-enyl]-3H-purin-6-one IUPAC Name: 2-amino-9-[(1R,4S)-4-benzyl-4-(hydroxymethyl)cyclopent-2-en-1-yl]-3H-purin-6-one Traditional Name: 2-amino-9-[(1R,4S)-4-benzyl-4-methylol-cyclopent-2-en-1-yl]-3H-purin-6-one Formula: C18H19N5O2 MolecularWeight: 337.37576

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C=CC1(CC2=CC=CC=C2)CO)N3C=NC4=C3NC(=NC4=O)N

Isomeric SMILES

C1[C@H](C=C[C@@]1(CC2=CC=CC=C2)CO)N3C=NC4=C3NC(=NC4=O)N

InChI

InChI=1S/C18H19N5O2/c19-17-21-15-14(16(25)22-17)20-11-23(15)13-6-7-18(9-13,10-24)8-12-4-2-1-3-5-12/h1-7,11,13,24H,8-10H2,(H3,19,21,22,25)/t13-,18-/m0/s1