tert-butyl 3-(1-methylisoquinolin-6-yl)-3-oxidanylidene-propanoate

Systemtic Name: tert-butyl 3-(1-methylisoquinolin-6-yl)-3-oxidanylidene-propanoate Openeye Name: tert-butyl 3-(1-methyl-6-isoquinolyl)-3-oxo-propanoate CAS Name: 3-(1-methyl-6-isoquinolinyl)-3-oxopropanoic acid tert-butyl ester IUPAC Name: tert-butyl 3-(1-methylisoquinolin-6-yl)-3-oxopropanoate Traditional Name: 3-keto-3-(1-methyl-6-isoquinolyl)propionic acid tert-butyl ester Formula: C17H19NO3 MolecularWeight: 285.33766

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=CC2=C1C=CC(=C2)C(=O)CC(=O)OC(C)(C)C

Isomeric SMILES

CC1=NC=CC2=C1C=CC(=C2)C(=O)CC(=O)OC(C)(C)C

InChI

InChI=1S/C17H19NO3/c1-11-14-6-5-13(9-12(14)7-8-18-11)15(19)10-16(20)21-17(2,3)4/h5-9H,10H2,1-4H3