[4-[(2-methylpropan-2-yl)oxycarbonylamino]phenyl] N-(3,4-dihydro-1H-isoquinolin-2-yl)carbamate

Systemtic Name: [4-[(2-methylpropan-2-yl)oxycarbonylamino]phenyl] N-(3,4-dihydro-1H-isoquinolin-2-yl)carbamate Openeye Name: [4-(tert-butoxycarbonylamino)phenyl] N-(3,4-dihydro-1H-isoquinolin-2-yl)carbamate CAS Name: N-(3,4-dihydro-1H-isoquinolin-2-yl)carbamic acid [4-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]phenyl] ester IUPAC Name: [4-[(2-methylpropan-2-yl)oxycarbonylamino]phenyl] N-(3,4-dihydro-1H-isoquinolin-2-yl)carbamate Traditional Name: N-(3,4-dihydro-1H-isoquinolin-2-yl)carbamic acid [4-(tert-butoxycarbonylamino)phenyl] ester Formula: C21H25N3O4 MolecularWeight: 383.4409

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1=CC=C(C=C1)OC(=O)NN2CCC3=CC=CC=C3C2

Isomeric SMILES

CC(C)(C)OC(=O)NC1=CC=C(C=C1)OC(=O)NN2CCC3=CC=CC=C3C2

InChI

InChI=1S/C21H25N3O4/c1-21(2,3)28-19(25)22-17-8-10-18(11-9-17)27-20(26)23-24-13-12-15-6-4-5-7-16(15)14-24/h4-11H,12-14H2,1-3H3,(H,22,25)(H,23,26)