3-(6-azanylpyridin-3-yl)-2-[1-(1-oxidanylidene-1-pyrrolidin-1-yl-propan-2-yl)imidazol-4-yl]propanoic acid

Systemtic Name: 3-(6-azanylpyridin-3-yl)-2-[1-(1-oxidanylidene-1-pyrrolidin-1-yl-propan-2-yl)imidazol-4-yl]propanoic acid Openeye Name: 3-(6-amino-3-pyridyl)-2-[1-(1-methyl-2-oxo-2-pyrrolidin-1-yl-ethyl)imidazol-4-yl]propanoic acid CAS Name: 3-(6-amino-3-pyridinyl)-2-[1-[1-oxo-1-(1-pyrrolidinyl)propan-2-yl]-4-imidazolyl]propanoic acid IUPAC Name: 3-(6-aminopyridin-3-yl)-2-[1-(1-oxo-1-pyrrolidin-1-ylpropan-2-yl)imidazol-4-yl]propanoic acid Traditional Name: 3-(6-amino-3-pyridyl)-2-[1-(2-keto-1-methyl-2-pyrrolidino-ethyl)imidazol-4-yl]propionic acid Formula: C18H23N5O3 MolecularWeight: 357.40692

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCCC1)N2C=C(N=C2)C(CC3=CN=C(C=C3)N)C(=O)O

Isomeric SMILES

CC(C(=O)N1CCCC1)N2C=C(N=C2)C(CC3=CN=C(C=C3)N)C(=O)O

InChI

InChI=1S/C18H23N5O3/c1-12(17(24)22-6-2-3-7-22)23-10-15(21-11-23)14(18(25)26)8-13-4-5-16(19)20-9-13/h4-5,9-12,14H,2-3,6-8H2,1H3,(H2,19,20)(H,25,26)