O3-tert-butyl O1-ethyl 3-methyl-2,4-dihydro-1H-isoquinoline-1,3-dicarboxylate

Systemtic Name: O3-tert-butyl O1-ethyl 3-methyl-2,4-dihydro-1H-isoquinoline-1,3-dicarboxylate Openeye Name: O3-tert-butyl O1-ethyl 3-methyl-2,4-dihydro-1H-isoquinoline-1,3-dicarboxylate CAS Name: 3-methyl-2,4-dihydro-1H-isoquinoline-1,3-dicarboxylic acid O3-tert-butyl ester O1-ethyl ester IUPAC Name: 3-O-tert-butyl 1-O-ethyl 3-methyl-2,4-dihydro-1H-isoquinoline-1,3-dicarboxylate Traditional Name: 3-methyl-2,4-dihydro-1H-isoquinoline-1,3-dicarboxylic acid O3-tert-butyl ester O1-ethyl ester Formula: C18H25NO4 MolecularWeight: 319.3954

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1C2=CC=CC=C2CC(N1)(C)C(=O)OC(C)(C)C

Isomeric SMILES

CCOC(=O)C1C2=CC=CC=C2CC(N1)(C)C(=O)OC(C)(C)C

InChI

InChI=1S/C18H25NO4/c1-6-22-15(20)14-13-10-8-7-9-12(13)11-18(5,19-14)16(21)23-17(2,3)4/h7-10,14,19H,6,11H2,1-5H3