3-[5-methyl-2-oxidanylidene-6-(phenylmethyl)-1H-pyrazin-3-yl]propanoic acid

Systemtic Name: 3-[5-methyl-2-oxidanylidene-6-(phenylmethyl)-1H-pyrazin-3-yl]propanoic acid Openeye Name: 3-(6-benzyl-5-methyl-2-oxo-1H-pyrazin-3-yl)propanoic acid CAS Name: 3-[5-methyl-2-oxo-6-(phenylmethyl)-1H-pyrazin-3-yl]propanoic acid IUPAC Name: 3-(6-benzyl-5-methyl-2-oxo-1H-pyrazin-3-yl)propanoic acid Traditional Name: 3-(6-benzyl-2-keto-5-methyl-1H-pyrazin-3-yl)propionic acid Formula: C15H16N2O3 MolecularWeight: 272.29914

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=O)C(=N1)CCC(=O)O)CC2=CC=CC=C2

Isomeric SMILES

CC1=C(NC(=O)C(=N1)CCC(=O)O)CC2=CC=CC=C2

InChI

InChI=1S/C15H16N2O3/c1-10-13(9-11-5-3-2-4-6-11)17-15(20)12(16-10)7-8-14(18)19/h2-6H,7-9H2,1H3,(H,17,20)(H,18,19)