(8-methyl-4-oxidanylidene-1H-quinazolin-2-yl)methyl 2-chloranyl-4,6-dimethyl-pyridine-3-carboxylate

Systemtic Name: (8-methyl-4-oxidanylidene-1H-quinazolin-2-yl)methyl 2-chloranyl-4,6-dimethyl-pyridine-3-carboxylate Openeye Name: (8-methyl-4-oxo-1H-quinazolin-2-yl)methyl 2-chloro-4,6-dimethyl-pyridine-3-carboxylate CAS Name: 2-chloro-4,6-dimethyl-3-pyridinecarboxylic acid (8-methyl-4-oxo-1H-quinazolin-2-yl)methyl ester IUPAC Name: (8-methyl-4-oxo-1H-quinazolin-2-yl)methyl 2-chloro-4,6-dimethylpyridine-3-carboxylate Traditional Name: 2-chloro-4,6-dimethyl-nicotinic acid (4-keto-8-methyl-1H-quinazolin-2-yl)methyl ester Formula: C18H16ClN3O3 MolecularWeight: 357.79094

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1NC(=NC2=O)COC(=O)C3=C(N=C(C=C3C)C)Cl

Isomeric SMILES

CC1=CC=CC2=C1NC(=NC2=O)COC(=O)C3=C(N=C(C=C3C)C)Cl

InChI

InChI=1S/C18H16ClN3O3/c1-9-5-4-6-12-15(9)21-13(22-17(12)23)8-25-18(24)14-10(2)7-11(3)20-16(14)19/h4-7H,8H2,1-3H3,(H,21,22,23)