tert-butyl 2-cyano-2-[[4-[(2-methylquinolin-4-yl)methoxy]phenyl]methyl]cyclopropane-1-carboxylate

Systemtic Name: tert-butyl 2-cyano-2-[[4-[(2-methylquinolin-4-yl)methoxy]phenyl]methyl]cyclopropane-1-carboxylate Openeye Name: tert-butyl 2-cyano-2-[[4-[(2-methyl-4-quinolyl)methoxy]phenyl]methyl]cyclopropanecarboxylate CAS Name: 2-cyano-2-[[4-[(2-methyl-4-quinolinyl)methoxy]phenyl]methyl]-1-cyclopropanecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 2-cyano-2-[[4-[(2-methylquinolin-4-yl)methoxy]phenyl]methyl]cyclopropane-1-carboxylate Traditional Name: 2-cyano-2-[4-[(2-methyl-4-quinolyl)methoxy]benzyl]cyclopropanecarboxylic acid tert-butyl ester Formula: C27H28N2O3 MolecularWeight: 428.52282

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C(=C1)COC3=CC=C(C=C3)CC4(CC4C(=O)OC(C)(C)C)C#N

Isomeric SMILES

CC1=NC2=CC=CC=C2C(=C1)COC3=CC=C(C=C3)CC4(CC4C(=O)OC(C)(C)C)C#N

InChI

InChI=1S/C27H28N2O3/c1-18-13-20(22-7-5-6-8-24(22)29-18)16-31-21-11-9-19(10-12-21)14-27(17-28)15-23(27)25(30)32-26(2,3)4/h5-13,23H,14-16H2,1-4H3