diethyl 2-butyl-5,8-dimethyl-3,4-dihydro-1H-isoquinoline-6,7-dicarboxylate

Systemtic Name: diethyl 2-butyl-5,8-dimethyl-3,4-dihydro-1H-isoquinoline-6,7-dicarboxylate Openeye Name: diethyl 2-butyl-5,8-dimethyl-3,4-dihydro-1H-isoquinoline-6,7-dicarboxylate CAS Name: 2-butyl-5,8-dimethyl-3,4-dihydro-1H-isoquinoline-6,7-dicarboxylic acid diethyl ester IUPAC Name: diethyl 2-butyl-5,8-dimethyl-3,4-dihydro-1H-isoquinoline-6,7-dicarboxylate Traditional Name: 2-butyl-5,8-dimethyl-3,4-dihydro-1H-isoquinoline-6,7-dicarboxylic acid diethyl ester Formula: C21H31NO4 MolecularWeight: 361.47514

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1CCC2=C(C(=C(C(=C2C1)C)C(=O)OCC)C(=O)OCC)C

Isomeric SMILES

CCCCN1CCC2=C(C(=C(C(=C2C1)C)C(=O)OCC)C(=O)OCC)C

InChI

InChI=1S/C21H31NO4/c1-6-9-11-22-12-10-16-14(4)18(20(23)25-7-2)19(21(24)26-8-3)15(5)17(16)13-22/h6-13H2,1-5H3