6-chloranyl-9-[(1R,4S)-4-(nitromethyl)cyclopent-2-en-1-yl]purin-2-amine

Systemtic Name: 6-chloranyl-9-[(1R,4S)-4-(nitromethyl)cyclopent-2-en-1-yl]purin-2-amine Openeye Name: 6-chloro-9-[(1R,4S)-4-(nitromethyl)cyclopent-2-en-1-yl]purin-2-amine CAS Name: 6-chloro-9-[(1R,4S)-4-(nitromethyl)-1-cyclopent-2-enyl]-2-purinamine IUPAC Name: 6-chloro-9-[(1R,4S)-4-(nitromethyl)cyclopent-2-en-1-yl]purin-2-amine Traditional Name: [6-chloro-9-[(1R,4S)-4-(nitromethyl)cyclopent-2-en-1-yl]purin-2-yl]amine Formula: C11H11ClN6O2 MolecularWeight: 294.69704

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C=CC1N2C=NC3=C2N=C(N=C3Cl)N)C[N+](=O)[O-]

Isomeric SMILES

C1[C@@H](C=C[C@@H]1N2C=NC3=C2N=C(N=C3Cl)N)C[N+](=O)[O-]

InChI

InChI=1S/C11H11ClN6O2/c12-9-8-10(16-11(13)15-9)17(5-14-8)7-2-1-6(3-7)4-18(19)20/h1-2,5-7H,3-4H2,(H2,13,15,16)/t6-,7+/m1/s1