4-[carboxymethyl(1H-imidazo[2,1-f]purin-7-ylmethyl)amino]butanoic acid

Systemtic Name: 4-[carboxymethyl(1H-imidazo[2,1-f]purin-7-ylmethyl)amino]butanoic acid Openeye Name: 4-[carboxymethyl(1H-imidazo[2,1-f]purin-7-ylmethyl)amino]butanoic acid CAS Name: 4-[carboxymethyl(1H-imidazo[2,1-f]purin-7-ylmethyl)amino]butanoic acid IUPAC Name: 4-[carboxymethyl(1H-imidazo[2,1-f]purin-7-ylmethyl)amino]butanoic acid Traditional Name: 4-[carboxymethyl(1H-imidazo[2,1-f]purin-7-ylmethyl)amino]butyric acid Formula: C14H16N6O4 MolecularWeight: 332.31464

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(N2C=NC3=C(C2=N1)NC=N3)CN(CCCC(=O)O)CC(=O)O

Isomeric SMILES

C1=C(N2C=NC3=C(C2=N1)NC=N3)CN(CCCC(=O)O)CC(=O)O

InChI

InChI=1S/C14H16N6O4/c21-10(22)2-1-3-19(6-11(23)24)5-9-4-15-14-12-13(17-7-16-12)18-8-20(9)14/h4,7-8H,1-3,5-6H2,(H,16,17)(H,21,22)(H,23,24)