O3-tert-butyl O1-methyl isoquinoline-1,3-dicarboxylate

Systemtic Name: O3-tert-butyl O1-methyl isoquinoline-1,3-dicarboxylate Openeye Name: O3-tert-butyl O1-methyl isoquinoline-1,3-dicarboxylate CAS Name: isoquinoline-1,3-dicarboxylic acid O3-tert-butyl ester O1-methyl ester IUPAC Name: 3-O-tert-butyl 1-O-methyl isoquinoline-1,3-dicarboxylate Traditional Name: isoquinoline-1,3-dicarboxylic acid O3-tert-butyl ester O1-methyl ester Formula: C16H17NO4 MolecularWeight: 287.31048

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1=CC2=CC=CC=C2C(=N1)C(=O)OC

Isomeric SMILES

CC(C)(C)OC(=O)C1=CC2=CC=CC=C2C(=N1)C(=O)OC

InChI

InChI=1S/C16H17NO4/c1-16(2,3)21-14(18)12-9-10-7-5-6-8-11(10)13(17-12)15(19)20-4/h5-9H,1-4H3