2-(3-oxidanylidene-5-phenyl-2-propan-2-yl-1-pyridin-3-ylcarbonyl-2H-pyrazin-4-yl)ethanoic acid

Systemtic Name: 2-(3-oxidanylidene-5-phenyl-2-propan-2-yl-1-pyridin-3-ylcarbonyl-2H-pyrazin-4-yl)ethanoic acid Openeye Name: 2-[2-isopropyl-3-oxo-5-phenyl-1-(pyridine-3-carbonyl)-2H-pyrazin-4-yl]acetic acid CAS Name: 2-[3-oxo-1-[oxo(3-pyridinyl)methyl]-5-phenyl-2-propan-2-yl-2H-pyrazin-4-yl]acetic acid IUPAC Name: 2-[3-oxo-5-phenyl-2-propan-2-yl-1-(pyridine-3-carbonyl)-2H-pyrazin-4-yl]acetic acid Traditional Name: 2-(2-isopropyl-3-keto-1-nicotinoyl-5-phenyl-2H-pyrazin-4-yl)acetic acid Formula: C21H21N3O4 MolecularWeight: 379.40914

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1C(=O)N(C(=CN1C(=O)C2=CN=CC=C2)C3=CC=CC=C3)CC(=O)O

Isomeric SMILES

CC(C)C1C(=O)N(C(=CN1C(=O)C2=CN=CC=C2)C3=CC=CC=C3)CC(=O)O

InChI

InChI=1S/C21H21N3O4/c1-14(2)19-21(28)23(13-18(25)26)17(15-7-4-3-5-8-15)12-24(19)20(27)16-9-6-10-22-11-16/h3-12,14,19H,13H2,1-2H3,(H,25,26)