tert-butyl 4-isoquinolin-4-yl-2-methylidene-butanoate

Systemtic Name: tert-butyl 4-isoquinolin-4-yl-2-methylidene-butanoate Openeye Name: tert-butyl 4-(4-isoquinolyl)-2-methylene-butanoate CAS Name: 4-(4-isoquinolinyl)-2-methylenebutanoic acid tert-butyl ester IUPAC Name: tert-butyl 4-isoquinolin-4-yl-2-methylidenebutanoate Traditional Name: 2-[2-(4-isoquinolyl)ethyl]acrylic acid tert-butyl ester Formula: C18H21NO2 MolecularWeight: 283.36484

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C(=C)CCC1=CN=CC2=CC=CC=C21

Isomeric SMILES

CC(C)(C)OC(=O)C(=C)CCC1=CN=CC2=CC=CC=C21

InChI

InChI=1S/C18H21NO2/c1-13(17(20)21-18(2,3)4)9-10-15-12-19-11-14-7-5-6-8-16(14)15/h5-8,11-12H,1,9-10H2,2-4H3