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

Systemtic Name: 2-azanyl-9-[(1R,4S)-4-(hydroxymethyl)-4-nonyl-cyclopent-2-en-1-yl]-3H-purin-6-one Openeye Name: 2-amino-9-[(1R,4S)-4-(hydroxymethyl)-4-nonyl-cyclopent-2-en-1-yl]-3H-purin-6-one CAS Name: 2-amino-9-[(1R,4S)-4-(hydroxymethyl)-4-nonyl-1-cyclopent-2-enyl]-3H-purin-6-one IUPAC Name: 2-amino-9-[(1R,4S)-4-(hydroxymethyl)-4-nonylcyclopent-2-en-1-yl]-3H-purin-6-one Traditional Name: 2-amino-9-[(1R,4S)-4-methylol-4-nonyl-cyclopent-2-en-1-yl]-3H-purin-6-one Formula: C20H31N5O2 MolecularWeight: 373.49244

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC1(CC(C=C1)N2C=NC3=C2NC(=NC3=O)N)CO

Isomeric SMILES

CCCCCCCCC[C@@]1(C[C@H](C=C1)N2C=NC3=C2NC(=NC3=O)N)CO

InChI

InChI=1S/C20H31N5O2/c1-2-3-4-5-6-7-8-10-20(13-26)11-9-15(12-20)25-14-22-16-17(25)23-19(21)24-18(16)27/h9,11,14-15,26H,2-8,10,12-13H2,1H3,(H3,21,23,24,27)/t15-,20+/m0/s1