2-[5-chloranyl-2-oxidanylidene-6-phenyl-3-(propan-2-ylamino)pyrazin-1-yl]ethanoic acid

Systemtic Name: 2-[5-chloranyl-2-oxidanylidene-6-phenyl-3-(propan-2-ylamino)pyrazin-1-yl]ethanoic acid Openeye Name: 2-[5-chloro-3-(isopropylamino)-2-oxo-6-phenyl-pyrazin-1-yl]acetic acid CAS Name: 2-[5-chloro-2-oxo-6-phenyl-3-(propan-2-ylamino)-1-pyrazinyl]acetic acid IUPAC Name: 2-[5-chloro-2-oxo-6-phenyl-3-(propan-2-ylamino)pyrazin-1-yl]acetic acid Traditional Name: 2-[5-chloro-3-(isopropylamino)-2-keto-6-phenyl-pyrazin-1-yl]acetic acid Formula: C15H16ClN3O3 MolecularWeight: 321.75884

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC1=NC(=C(N(C1=O)CC(=O)O)C2=CC=CC=C2)Cl

Isomeric SMILES

CC(C)NC1=NC(=C(N(C1=O)CC(=O)O)C2=CC=CC=C2)Cl

InChI

InChI=1S/C15H16ClN3O3/c1-9(2)17-14-15(22)19(8-11(20)21)12(13(16)18-14)10-6-4-3-5-7-10/h3-7,9H,8H2,1-2H3,(H,17,18)(H,20,21)