(3-methylquinoxalin-2-yl)methyl 3-acetamidoadamantane-1-carboxylate

Systemtic Name: (3-methylquinoxalin-2-yl)methyl 3-acetamidoadamantane-1-carboxylate Openeye Name: (3-methylquinoxalin-2-yl)methyl 3-acetamidoadamantane-1-carboxylate CAS Name: 3-acetamido-1-adamantanecarboxylic acid (3-methyl-2-quinoxalinyl)methyl ester IUPAC Name: (3-methylquinoxalin-2-yl)methyl 3-acetamidoadamantane-1-carboxylate Traditional Name: 3-acetamidoadamantane-1-carboxylic acid (3-methylquinoxalin-2-yl)methyl ester Formula: C23H27N3O3 MolecularWeight: 393.47878

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2N=C1COC(=O)C34CC5CC(C3)CC(C5)(C4)NC(=O)C

Isomeric SMILES

CC1=NC2=CC=CC=C2N=C1COC(=O)C34CC5CC(C3)CC(C5)(C4)NC(=O)C

InChI

InChI=1S/C23H27N3O3/c1-14-20(25-19-6-4-3-5-18(19)24-14)12-29-21(28)22-8-16-7-17(9-22)11-23(10-16,13-22)26-15(2)27/h3-6,16-17H,7-13H2,1-2H3,(H,26,27)