2-azanyl-9-[(1R,4R)-4-[2-di(propan-2-yloxy)phosphorylethyl]cyclopent-2-en-1-yl]-3H-purin-6-one

Systemtic Name: 2-azanyl-9-[(1R,4R)-4-[2-di(propan-2-yloxy)phosphorylethyl]cyclopent-2-en-1-yl]-3H-purin-6-one Openeye Name: 2-amino-9-[(1R,4R)-4-(2-diisopropoxyphosphorylethyl)cyclopent-2-en-1-yl]-3H-purin-6-one CAS Name: 2-amino-9-[(1R,4R)-4-[2-di(propan-2-yloxy)phosphorylethyl]-1-cyclopent-2-enyl]-3H-purin-6-one IUPAC Name: 2-amino-9-[(1R,4R)-4-[2-di(propan-2-yloxy)phosphorylethyl]cyclopent-2-en-1-yl]-3H-purin-6-one Traditional Name: 2-amino-9-[(1R,4R)-4-(2-diisopropoxyphosphorylethyl)cyclopent-2-en-1-yl]-3H-purin-6-one Formula: C18H28N5O4P MolecularWeight: 409.419781

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OP(=O)(CCC1CC(C=C1)N2C=NC3=C2NC(=NC3=O)N)OC(C)C

Isomeric SMILES

CC(C)OP(=O)(CC[C@H]1C[C@H](C=C1)N2C=NC3=C2NC(=NC3=O)N)OC(C)C

InChI

InChI=1S/C18H28N5O4P/c1-11(2)26-28(25,27-12(3)4)8-7-13-5-6-14(9-13)23-10-20-15-16(23)21-18(19)22-17(15)24/h5-6,10-14H,7-9H2,1-4H3,(H3,19,21,22,24)/t13-,14-/m0/s1