tert-butyl [7-[(phenylmethyl)amino]-3,4-dihydro-1H-isoquinolin-2-yl] carbonate

Systemtic Name: tert-butyl [7-[(phenylmethyl)amino]-3,4-dihydro-1H-isoquinolin-2-yl] carbonate Openeye Name: [7-(benzylamino)-3,4-dihydro-1H-isoquinolin-2-yl] tert-butyl carbonate CAS Name: carbonic acid tert-butyl [7-[(phenylmethyl)amino]-3,4-dihydro-1H-isoquinolin-2-yl] ester IUPAC Name: [7-(benzylamino)-3,4-dihydro-1H-isoquinolin-2-yl] tert-butyl carbonate Traditional Name: carbonic acid [7-(benzylamino)-3,4-dihydro-1H-isoquinolin-2-yl] tert-butyl ester Formula: C21H26N2O3 MolecularWeight: 354.44274

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)ON1CCC2=C(C1)C=C(C=C2)NCC3=CC=CC=C3

Isomeric SMILES

CC(C)(C)OC(=O)ON1CCC2=C(C1)C=C(C=C2)NCC3=CC=CC=C3

InChI

InChI=1S/C21H26N2O3/c1-21(2,3)25-20(24)26-23-12-11-17-9-10-19(13-18(17)15-23)22-14-16-7-5-4-6-8-16/h4-10,13,22H,11-12,14-15H2,1-3H3