diethyl 6-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-1,3,4,5-tetrahydroindene-2,2-dicarboxylate

Systemtic Name: diethyl 6-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-1,3,4,5-tetrahydroindene-2,2-dicarboxylate Openeye Name: diethyl 6-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-1,3,4,5-tetrahydroindene-2,2-dicarboxylate CAS Name: 6-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-1,3,4,5-tetrahydroindene-2,2-dicarboxylic acid diethyl ester IUPAC Name: diethyl 6-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-1,3,4,5-tetrahydroindene-2,2-dicarboxylate Traditional Name: 6-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-1,3,4,5-tetrahydroindene-2,2-dicarboxylic acid diethyl ester Formula: C25H31NO4 MolecularWeight: 409.51794

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CC2=C(C1)C=C(CC2)CN3CCC4=CC=CC=C4C3)C(=O)OCC

Isomeric SMILES

CCOC(=O)C1(CC2=C(C1)C=C(CC2)CN3CCC4=CC=CC=C4C3)C(=O)OCC

InChI

InChI=1S/C25H31NO4/c1-3-29-23(27)25(24(28)30-4-2)14-20-10-9-18(13-22(20)15-25)16-26-12-11-19-7-5-6-8-21(19)17-26/h5-8,13H,3-4,9-12,14-17H2,1-2H3