2-[1-(4-chlorophenyl)carbonyl-3-oxidanylidene-5-phenyl-2-propan-2-yl-2H-pyrazin-4-yl]ethanoic acid

Systemtic Name: 2-[1-(4-chlorophenyl)carbonyl-3-oxidanylidene-5-phenyl-2-propan-2-yl-2H-pyrazin-4-yl]ethanoic acid Openeye Name: 2-[1-(4-chlorobenzoyl)-2-isopropyl-3-oxo-5-phenyl-2H-pyrazin-4-yl]acetic acid CAS Name: 2-[1-[(4-chlorophenyl)-oxomethyl]-3-oxo-5-phenyl-2-propan-2-yl-2H-pyrazin-4-yl]acetic acid IUPAC Name: 2-[1-(4-chlorobenzoyl)-3-oxo-5-phenyl-2-propan-2-yl-2H-pyrazin-4-yl]acetic acid Traditional Name: 2-[1-(4-chlorobenzoyl)-2-isopropyl-3-keto-5-phenyl-2H-pyrazin-4-yl]acetic acid Formula: C22H21ClN2O4 MolecularWeight: 412.86614

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H21ClN2O4/c1-14(2)20-22(29)24(13-19(26)27)18(15-6-4-3-5-7-15)12-25(20)21(28)16-8-10-17(23)11-9-16/h3-12,14,20H,13H2,1-2H3,(H,26,27)