methyl 3-[(5-cyano-3,4-dimethyl-6-oxidanylidene-pyridazin-1-yl)methyl]benzoate

Systemtic Name: methyl 3-[(5-cyano-3,4-dimethyl-6-oxidanylidene-pyridazin-1-yl)methyl]benzoate Openeye Name: methyl 3-[(5-cyano-3,4-dimethyl-6-oxo-pyridazin-1-yl)methyl]benzoate CAS Name: 3-[(5-cyano-3,4-dimethyl-6-oxo-1-pyridazinyl)methyl]benzoic acid methyl ester IUPAC Name: methyl 3-[(5-cyano-3,4-dimethyl-6-oxopyridazin-1-yl)methyl]benzoate Traditional Name: 3-[(5-cyano-6-keto-3,4-dimethyl-pyridazin-1-yl)methyl]benzoic acid methyl ester Formula: C16H15N3O3 MolecularWeight: 297.3086

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N=C1C)CC2=CC=CC(=C2)C(=O)OC)C#N

Isomeric SMILES

CC1=C(C(=O)N(N=C1C)CC2=CC=CC(=C2)C(=O)OC)C#N

InChI

InChI=1S/C16H15N3O3/c1-10-11(2)18-19(15(20)14(10)8-17)9-12-5-4-6-13(7-12)16(21)22-3/h4-7H,9H2,1-3H3