(1R,4S)-4-(6-aminopurin-9-yl)-1-(phenylmethoxymethyl)cyclopent-2-ene-1-carbonitrile

Systemtic Name: (1R,4S)-4-(6-aminopurin-9-yl)-1-(phenylmethoxymethyl)cyclopent-2-ene-1-carbonitrile Openeye Name: (1R,4S)-4-(6-aminopurin-9-yl)-1-(benzyloxymethyl)cyclopent-2-ene-1-carbonitrile CAS Name: (1R,4S)-4-(6-aminopurin-9-yl)-1-(phenylmethoxymethyl)-1-cyclopent-2-enecarbonitrile IUPAC Name: (1R,4S)-4-(6-aminopurin-9-yl)-1-(phenylmethoxymethyl)cyclopent-2-ene-1-carbonitrile Traditional Name: (1R,4S)-4-adenin-9-yl-1-(benzoxymethyl)cyclopent-2-ene-1-carbonitrile Formula: C19H18N6O MolecularWeight: 346.38582

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C=CC1(COCC2=CC=CC=C2)C#N)N3C=NC4=C3N=CN=C4N

Isomeric SMILES

C1[C@@H](C=C[C@@]1(COCC2=CC=CC=C2)C#N)N3C=NC4=C3N=CN=C4N

InChI

InChI=1S/C19H18N6O/c20-10-19(11-26-9-14-4-2-1-3-5-14)7-6-15(8-19)25-13-24-16-17(21)22-12-23-18(16)25/h1-7,12-13,15H,8-9,11H2,(H2,21,22,23)/t15-,19+/m1/s1