[5,7-bis(chloranyl)-2-methyl-quinolin-8-yl] adamantane-1-carboxylate

Systemtic Name: [5,7-bis(chloranyl)-2-methyl-quinolin-8-yl] adamantane-1-carboxylate Openeye Name: (5,7-dichloro-2-methyl-8-quinolyl) adamantane-1-carboxylate CAS Name: 1-adamantanecarboxylic acid (5,7-dichloro-2-methyl-8-quinolinyl) ester IUPAC Name: (5,7-dichloro-2-methylquinolin-8-yl) adamantane-1-carboxylate Traditional Name: adamantane-1-carboxylic acid (5,7-dichloro-2-methyl-8-quinolyl) ester Formula: C21H21Cl2NO2 MolecularWeight: 390.30294

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=C1)C(=CC(=C2OC(=O)C34CC5CC(C3)CC(C5)C4)Cl)Cl

Isomeric SMILES

CC1=NC2=C(C=C1)C(=CC(=C2OC(=O)C34CC5CC(C3)CC(C5)C4)Cl)Cl

InChI

InChI=1S/C21H21Cl2NO2/c1-11-2-3-15-16(22)7-17(23)19(18(15)24-11)26-20(25)21-8-12-4-13(9-21)6-14(5-12)10-21/h2-3,7,12-14H,4-6,8-10H2,1H3