3-methyl-4-(pyrazin-2-ylcarbonylamino)benzoic acid

Systemtic Name: 3-methyl-4-(pyrazin-2-ylcarbonylamino)benzoic acid Openeye Name: 3-methyl-4-(pyrazine-2-carbonylamino)benzoic acid CAS Name: 3-methyl-4-[[oxo(2-pyrazinyl)methyl]amino]benzoic acid IUPAC Name: 3-methyl-4-(pyrazine-2-carbonylamino)benzoic acid Traditional Name: 3-methyl-4-(pyrazinoylamino)benzoic acid Formula: C13H11N3O3 MolecularWeight: 257.24474

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)O)NC(=O)C2=NC=CN=C2

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)O)NC(=O)C2=NC=CN=C2

InChI

InChI=1S/C13H11N3O3/c1-8-6-9(13(18)19)2-3-10(8)16-12(17)11-7-14-4-5-15-11/h2-7H,1H3,(H,16,17)(H,18,19)