methyl 4-(4-chloranyl-6-cyano-quinazolin-2-yl)cyclohexane-1-carboxylate

Systemtic Name: methyl 4-(4-chloranyl-6-cyano-quinazolin-2-yl)cyclohexane-1-carboxylate Openeye Name: methyl 4-(4-chloro-6-cyano-quinazolin-2-yl)cyclohexanecarboxylate CAS Name: 4-(4-chloro-6-cyano-2-quinazolinyl)-1-cyclohexanecarboxylic acid methyl ester IUPAC Name: methyl 4-(4-chloro-6-cyanoquinazolin-2-yl)cyclohexane-1-carboxylate Traditional Name: 4-(4-chloro-6-cyano-quinazolin-2-yl)cyclohexanecarboxylic acid methyl ester Formula: C17H16ClN3O2 MolecularWeight: 329.78084

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CCC(CC1)C2=NC3=C(C=C(C=C3)C#N)C(=N2)Cl

Isomeric SMILES

COC(=O)C1CCC(CC1)C2=NC3=C(C=C(C=C3)C#N)C(=N2)Cl

InChI

InChI=1S/C17H16ClN3O2/c1-23-17(22)12-5-3-11(4-6-12)16-20-14-7-2-10(9-19)8-13(14)15(18)21-16/h2,7-8,11-12H,3-6H2,1H3