methyl 6-[(3-chlorophenyl)methyl]-5-methyl-7-oxidanylidene-1H-pyrazolo[1,5-a]pyrimidine-3-carboxylate

Systemtic Name: methyl 6-[(3-chlorophenyl)methyl]-5-methyl-7-oxidanylidene-1H-pyrazolo[1,5-a]pyrimidine-3-carboxylate Openeye Name: methyl 6-[(3-chlorophenyl)methyl]-5-methyl-7-oxo-1H-pyrazolo[1,5-a]pyrimidine-3-carboxylate CAS Name: 6-[(3-chlorophenyl)methyl]-5-methyl-7-oxo-1H-pyrazolo[1,5-a]pyrimidine-3-carboxylic acid methyl ester IUPAC Name: methyl 6-[(3-chlorophenyl)methyl]-5-methyl-7-oxo-1H-pyrazolo[1,5-a]pyrimidine-3-carboxylate Traditional Name: 6-(3-chlorobenzyl)-7-keto-5-methyl-1H-pyrazolo[1,5-a]pyrimidine-3-carboxylic acid methyl ester Formula: C16H14ClN3O3 MolecularWeight: 331.75366

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N2C(=N1)C(=CN2)C(=O)OC)CC3=CC(=CC=C3)Cl

Isomeric SMILES

CC1=C(C(=O)N2C(=N1)C(=CN2)C(=O)OC)CC3=CC(=CC=C3)Cl

InChI

InChI=1S/C16H14ClN3O3/c1-9-12(7-10-4-3-5-11(17)6-10)15(21)20-14(19-9)13(8-18-20)16(22)23-2/h3-6,8,18H,7H2,1-2H3