(2-chloranyl-7-methoxy-quinolin-3-yl)methyl 3-acetamidoadamantane-1-carboxylate

Systemtic Name: (2-chloranyl-7-methoxy-quinolin-3-yl)methyl 3-acetamidoadamantane-1-carboxylate Openeye Name: (2-chloro-7-methoxy-3-quinolyl)methyl 3-acetamidoadamantane-1-carboxylate CAS Name: 3-acetamido-1-adamantanecarboxylic acid (2-chloro-7-methoxy-3-quinolinyl)methyl ester IUPAC Name: (2-chloro-7-methoxyquinolin-3-yl)methyl 3-acetamidoadamantane-1-carboxylate Traditional Name: 3-acetamidoadamantane-1-carboxylic acid (2-chloro-7-methoxy-3-quinolyl)methyl ester Formula: C24H27ClN2O4 MolecularWeight: 442.93518

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC12CC3CC(C1)CC(C3)(C2)C(=O)OCC4=C(N=C5C=C(C=CC5=C4)OC)Cl

Isomeric SMILES

CC(=O)NC12CC3CC(C1)CC(C3)(C2)C(=O)OCC4=C(N=C5C=C(C=CC5=C4)OC)Cl

InChI

InChI=1S/C24H27ClN2O4/c1-14(28)27-24-10-15-5-16(11-24)9-23(8-15,13-24)22(29)31-12-18-6-17-3-4-19(30-2)7-20(17)26-21(18)25/h3-4,6-7,15-16H,5,8-13H2,1-2H3,(H,27,28)