2-[4-[(1-methylindol-3-yl)methyl]-1-oxidanylidene-phthalazin-2-yl]-2-phenyl-ethanoic acid

Systemtic Name: 2-[4-[(1-methylindol-3-yl)methyl]-1-oxidanylidene-phthalazin-2-yl]-2-phenyl-ethanoic acid Openeye Name: 2-[4-[(1-methylindol-3-yl)methyl]-1-oxo-phthalazin-2-yl]-2-phenyl-acetic acid CAS Name: 2-[4-[(1-methyl-3-indolyl)methyl]-1-oxo-2-phthalazinyl]-2-phenylacetic acid IUPAC Name: 2-[4-[(1-methylindol-3-yl)methyl]-1-oxophthalazin-2-yl]-2-phenylacetic acid Traditional Name: 2-[1-keto-4-[(1-methylindol-3-yl)methyl]phthalazin-2-yl]-2-phenyl-acetic acid Formula: C26H21N3O3 MolecularWeight: 423.46324

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C2=CC=CC=C21)CC3=NN(C(=O)C4=CC=CC=C43)C(C5=CC=CC=C5)C(=O)O

Isomeric SMILES

CN1C=C(C2=CC=CC=C21)CC3=NN(C(=O)C4=CC=CC=C43)C(C5=CC=CC=C5)C(=O)O

InChI

InChI=1S/C26H21N3O3/c1-28-16-18(19-11-7-8-14-23(19)28)15-22-20-12-5-6-13-21(20)25(30)29(27-22)24(26(31)32)17-9-3-2-4-10-17/h2-14,16,24H,15H2,1H3,(H,31,32)