2-(6-azanylpurin-7-yl)pent-4-enoic acid

Systemtic Name: 2-(6-azanylpurin-7-yl)pent-4-enoic acid Openeye Name: 2-(6-aminopurin-7-yl)pent-4-enoic acid CAS Name: 2-(6-amino-7-purinyl)-4-pentenoic acid IUPAC Name: 2-(6-aminopurin-7-yl)pent-4-enoic acid Traditional Name: 2-(6-aminopurin-7-yl)pent-4-enoic acid Formula: C10H11N5O2 MolecularWeight: 233.22664

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Descriptors Computed from Structure

Canonical SMILES:

C=CCC(C(=O)O)N1C=NC2=C1C(=NC=N2)N

Isomeric SMILES

C=CCC(C(=O)O)N1C=NC2=C1C(=NC=N2)N

InChI

InChI=1S/C10H11N5O2/c1-2-3-6(10(16)17)15-5-14-9-7(15)8(11)12-4-13-9/h2,4-6H,1,3H2,(H,16,17)(H2,11,12,13)