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

Systemtic Name: 4-[ethanoyl(1H-imidazo[2,1-f]purin-7-ylmethyl)amino]butanoic acid Openeye Name: 4-[acetyl(1H-imidazo[2,1-f]purin-7-ylmethyl)amino]butanoic acid CAS Name: 4-[acetyl(1H-imidazo[2,1-f]purin-7-ylmethyl)amino]butanoic acid IUPAC Name: 4-[acetyl(1H-imidazo[2,1-f]purin-7-ylmethyl)amino]butanoic acid Traditional Name: 4-[acetyl(1H-imidazo[2,1-f]purin-7-ylmethyl)amino]butyric acid Formula: C14H16N6O3 MolecularWeight: 316.31524

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N(CCCC(=O)O)CC1=CN=C2N1C=NC3=C2NC=N3

Isomeric SMILES

CC(=O)N(CCCC(=O)O)CC1=CN=C2N1C=NC3=C2NC=N3

InChI

InChI=1S/C14H16N6O3/c1-9(21)19(4-2-3-11(22)23)6-10-5-15-14-12-13(17-7-16-12)18-8-20(10)14/h5,7-8H,2-4,6H2,1H3,(H,16,17)(H,22,23)