2-[3-[(4,5-diphenyl-1,3-oxazol-2-yl)methyl]-4-oxidanylidene-phthalazin-1-yl]ethanoic acid

Systemtic Name: 2-[3-[(4,5-diphenyl-1,3-oxazol-2-yl)methyl]-4-oxidanylidene-phthalazin-1-yl]ethanoic acid Openeye Name: 2-[3-[(4,5-diphenyloxazol-2-yl)methyl]-4-oxo-phthalazin-1-yl]acetic acid CAS Name: 2-[3-[(4,5-diphenyl-2-oxazolyl)methyl]-4-oxo-1-phthalazinyl]acetic acid IUPAC Name: 2-[3-[(4,5-diphenyl-1,3-oxazol-2-yl)methyl]-4-oxophthalazin-1-yl]acetic acid Traditional Name: 2-[3-[(4,5-diphenyloxazol-2-yl)methyl]-4-keto-phthalazin-1-yl]acetic acid Formula: C26H19N3O4 MolecularWeight: 437.44676

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(OC(=N2)CN3C(=O)C4=CC=CC=C4C(=N3)CC(=O)O)C5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)C2=C(OC(=N2)CN3C(=O)C4=CC=CC=C4C(=N3)CC(=O)O)C5=CC=CC=C5

InChI

InChI=1S/C26H19N3O4/c30-23(31)15-21-19-13-7-8-14-20(19)26(32)29(28-21)16-22-27-24(17-9-3-1-4-10-17)25(33-22)18-11-5-2-6-12-18/h1-14H,15-16H2,(H,30,31)