methyl 4-(7-chloranyl-1-methyl-3-propyl-pyrazolo[4,3-d]pyrimidin-5-yl)benzoate

Systemtic Name: methyl 4-(7-chloranyl-1-methyl-3-propyl-pyrazolo[4,3-d]pyrimidin-5-yl)benzoate Openeye Name: methyl 4-(7-chloro-1-methyl-3-propyl-pyrazolo[4,3-d]pyrimidin-5-yl)benzoate CAS Name: 4-(7-chloro-1-methyl-3-propyl-5-pyrazolo[4,3-d]pyrimidinyl)benzoic acid methyl ester IUPAC Name: methyl 4-(7-chloro-1-methyl-3-propylpyrazolo[4,3-d]pyrimidin-5-yl)benzoate Traditional Name: 4-(7-chloro-1-methyl-3-propyl-pyrazolo[4,3-d]pyrimidin-5-yl)benzoic acid methyl ester Formula: C17H17ClN4O2 MolecularWeight: 344.79548

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN(C2=C1N=C(N=C2Cl)C3=CC=C(C=C3)C(=O)OC)C

Isomeric SMILES

CCCC1=NN(C2=C1N=C(N=C2Cl)C3=CC=C(C=C3)C(=O)OC)C

InChI

InChI=1S/C17H17ClN4O2/c1-4-5-12-13-14(22(2)21-12)15(18)20-16(19-13)10-6-8-11(9-7-10)17(23)24-3/h6-9H,4-5H2,1-3H3