2-(5,7-dimethyl-4-oxidanylidene-3-phenyl-pyrrolo[3,4-d]pyridazin-6-yl)ethanoic acid

Systemtic Name: 2-(5,7-dimethyl-4-oxidanylidene-3-phenyl-pyrrolo[3,4-d]pyridazin-6-yl)ethanoic acid Openeye Name: 2-(5,7-dimethyl-4-oxo-3-phenyl-pyrrolo[3,4-d]pyridazin-6-yl)acetic acid CAS Name: 2-(5,7-dimethyl-4-oxo-3-phenyl-6-pyrrolo[3,4-d]pyridazinyl)acetic acid IUPAC Name: 2-(5,7-dimethyl-4-oxo-3-phenylpyrrolo[3,4-d]pyridazin-6-yl)acetic acid Traditional Name: 2-(4-keto-5,7-dimethyl-3-phenyl-pyrrolo[3,4-d]pyridazin-6-yl)acetic acid Formula: C16H15N3O3 MolecularWeight: 297.3086

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C=NN(C(=O)C2=C(N1CC(=O)O)C)C3=CC=CC=C3

Isomeric SMILES

CC1=C2C=NN(C(=O)C2=C(N1CC(=O)O)C)C3=CC=CC=C3

InChI

InChI=1S/C16H15N3O3/c1-10-13-8-17-19(12-6-4-3-5-7-12)16(22)15(13)11(2)18(10)9-14(20)21/h3-8H,9H2,1-2H3,(H,20,21)