tert-butyl 4-(7-ethoxyisoquinolin-1-yl)piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-(7-ethoxyisoquinolin-1-yl)piperazine-1-carboxylate Openeye Name: tert-butyl 4-(7-ethoxy-1-isoquinolyl)piperazine-1-carboxylate CAS Name: 4-(7-ethoxy-1-isoquinolinyl)-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-(7-ethoxyisoquinolin-1-yl)piperazine-1-carboxylate Traditional Name: 4-(7-ethoxy-1-isoquinolyl)piperazine-1-carboxylic acid tert-butyl ester Formula: C20H27N3O3 MolecularWeight: 357.44668

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)C=CN=C2N3CCN(CC3)C(=O)OC(C)(C)C

Isomeric SMILES

CCOC1=CC2=C(C=C1)C=CN=C2N3CCN(CC3)C(=O)OC(C)(C)C

InChI

InChI=1S/C20H27N3O3/c1-5-25-16-7-6-15-8-9-21-18(17(15)14-16)22-10-12-23(13-11-22)19(24)26-20(2,3)4/h6-9,14H,5,10-13H2,1-4H3