ethyl 8-iodanyl-1,4,4-trimethyl-5H-pyrazolo[4,3-h]quinazoline-3-carboxylate

Systemtic Name: ethyl 8-iodanyl-1,4,4-trimethyl-5H-pyrazolo[4,3-h]quinazoline-3-carboxylate Openeye Name: ethyl 8-iodo-1,4,4-trimethyl-5H-pyrazolo[4,3-h]quinazoline-3-carboxylate CAS Name: 8-iodo-1,4,4-trimethyl-5H-pyrazolo[4,3-h]quinazoline-3-carboxylic acid ethyl ester IUPAC Name: ethyl 8-iodo-1,4,4-trimethyl-5H-pyrazolo[4,3-h]quinazoline-3-carboxylate Traditional Name: 8-iodo-1,4,4-trimethyl-5H-pyrazolo[4,3-h]quinazoline-3-carboxylic acid ethyl ester Formula: C15H17IN4O2 MolecularWeight: 412.22555

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(C2=C1C(CC3=CN=C(N=C32)I)(C)C)C

Isomeric SMILES

CCOC(=O)C1=NN(C2=C1C(CC3=CN=C(N=C32)I)(C)C)C

InChI

InChI=1S/C15H17IN4O2/c1-5-22-13(21)11-9-12(20(4)19-11)10-8(6-15(9,2)3)7-17-14(16)18-10/h7H,5-6H2,1-4H3