tert-butyl [[6-chloranyl-5-(1-pyridin-3-ylindol-2-yl)hexyl]-[(2-methylpropan-2-yl)oxycarbonyl]amino] carbonate

Systemtic Name: tert-butyl [[6-chloranyl-5-(1-pyridin-3-ylindol-2-yl)hexyl]-[(2-methylpropan-2-yl)oxycarbonyl]amino] carbonate Openeye Name: [tert-butoxycarbonyl-[6-chloro-5-[1-(3-pyridyl)indol-2-yl]hexyl]amino] tert-butyl carbonate CAS Name: carbonic acid tert-butyl [[6-chloro-5-[1-(3-pyridinyl)-2-indolyl]hexyl]-[(2-methylpropan-2-yl)oxy-oxomethyl]amino] ester IUPAC Name: tert-butyl [[6-chloro-5-(1-pyridin-3-ylindol-2-yl)hexyl]-[(2-methylpropan-2-yl)oxycarbonyl]amino] carbonate Traditional Name: carbonic acid [tert-butoxycarbonyl-[6-chloro-5-[1-(3-pyridyl)indol-2-yl]hexyl]amino] tert-butyl ester Formula: C29H38ClN3O5 MolecularWeight: 544.08212

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N(CCCCC(CCl)C1=CC2=CC=CC=C2N1C3=CN=CC=C3)OC(=O)OC(C)(C)C

Isomeric SMILES

CC(C)(C)OC(=O)N(CCCCC(CCl)C1=CC2=CC=CC=C2N1C3=CN=CC=C3)OC(=O)OC(C)(C)C

InChI

InChI=1S/C29H38ClN3O5/c1-28(2,3)36-26(34)32(38-27(35)37-29(4,5)6)17-10-9-13-22(19-30)25-18-21-12-7-8-15-24(21)33(25)23-14-11-16-31-20-23/h7-8,11-12,14-16,18,20,22H,9-10,13,17,19H2,1-6H3