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

Systemtic Name: 2-[4-[(1-methylindol-3-yl)methyl]-1-oxidanylidene-phthalazin-2-yl]ethanoic acid Openeye Name: 2-[4-[(1-methylindol-3-yl)methyl]-1-oxo-phthalazin-2-yl]acetic acid CAS Name: 2-[4-[(1-methyl-3-indolyl)methyl]-1-oxo-2-phthalazinyl]acetic acid IUPAC Name: 2-[4-[(1-methylindol-3-yl)methyl]-1-oxophthalazin-2-yl]acetic acid Traditional Name: 2-[1-keto-4-[(1-methylindol-3-yl)methyl]phthalazin-2-yl]acetic acid Formula: C20H17N3O3 MolecularWeight: 347.36728

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H17N3O3/c1-22-11-13(14-6-4-5-9-18(14)22)10-17-15-7-2-3-8-16(15)20(26)23(21-17)12-19(24)25/h2-9,11H,10,12H2,1H3,(H,24,25)