tert-butyl N-[2-(6-bromanyl-1H-indol-3-yl)-2-[oxidanyl-(phenylmethyl)amino]ethyl]carbamate

Systemtic Name: tert-butyl N-[2-(6-bromanyl-1H-indol-3-yl)-2-[oxidanyl-(phenylmethyl)amino]ethyl]carbamate Openeye Name: tert-butyl N-[2-[benzyl(hydroxy)amino]-2-(6-bromo-1H-indol-3-yl)ethyl]carbamate CAS Name: N-[2-(6-bromo-1H-indol-3-yl)-2-[hydroxy-(phenylmethyl)amino]ethyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[2-[benzyl(hydroxy)amino]-2-(6-bromo-1H-indol-3-yl)ethyl]carbamate Traditional Name: N-[2-[benzyl(hydroxy)amino]-2-(6-bromo-1H-indol-3-yl)ethyl]carbamic acid tert-butyl ester Formula: C22H26BrN3O3 MolecularWeight: 460.36414

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCC(C1=CNC2=C1C=CC(=C2)Br)N(CC3=CC=CC=C3)O

Isomeric SMILES

CC(C)(C)OC(=O)NCC(C1=CNC2=C1C=CC(=C2)Br)N(CC3=CC=CC=C3)O

InChI

InChI=1S/C22H26BrN3O3/c1-22(2,3)29-21(27)25-13-20(26(28)14-15-7-5-4-6-8-15)18-12-24-19-11-16(23)9-10-17(18)19/h4-12,20,24,28H,13-14H2,1-3H3,(H,25,27)