2-[(2-methylpropan-2-yl)oxycarbonylamino]ethyl 3,4-dihydro-1H-isoquinoline-2-carboxylate

Systemtic Name: 2-[(2-methylpropan-2-yl)oxycarbonylamino]ethyl 3,4-dihydro-1H-isoquinoline-2-carboxylate Openeye Name: 2-(tert-butoxycarbonylamino)ethyl 3,4-dihydro-1H-isoquinoline-2-carboxylate CAS Name: 3,4-dihydro-1H-isoquinoline-2-carboxylic acid 2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]ethyl ester IUPAC Name: 2-[(2-methylpropan-2-yl)oxycarbonylamino]ethyl 3,4-dihydro-1H-isoquinoline-2-carboxylate Traditional Name: 3,4-dihydro-1H-isoquinoline-2-carboxylic acid 2-(tert-butoxycarbonylamino)ethyl ester Formula: C17H24N2O4 MolecularWeight: 320.38346

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCCOC(=O)N1CCC2=CC=CC=C2C1

Isomeric SMILES

CC(C)(C)OC(=O)NCCOC(=O)N1CCC2=CC=CC=C2C1

InChI

InChI=1S/C17H24N2O4/c1-17(2,3)23-15(20)18-9-11-22-16(21)19-10-8-13-6-4-5-7-14(13)12-19/h4-7H,8-12H2,1-3H3,(H,18,20)