tert-butyl 4-[2-[4-[5-(methylsulfonylamino)-1H-indol-3-yl]piperidin-1-yl]-1-oxidanyl-ethyl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[2-[4-[5-(methylsulfonylamino)-1H-indol-3-yl]piperidin-1-yl]-1-oxidanyl-ethyl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[1-hydroxy-2-[4-[5-(methanesulfonamido)-1H-indol-3-yl]-1-piperidyl]ethyl]piperidine-1-carboxylate CAS Name: 4-[1-hydroxy-2-[4-[5-(methanesulfonamido)-1H-indol-3-yl]-1-piperidinyl]ethyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[1-hydroxy-2-[4-[5-(methanesulfonamido)-1H-indol-3-yl]piperidin-1-yl]ethyl]piperidine-1-carboxylate Traditional Name: 4-[1-hydroxy-2-[4-[5-(methanesulfonamido)-1H-indol-3-yl]piperidino]ethyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C26H40N4O5S MolecularWeight: 520.6846

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)C(CN2CCC(CC2)C3=CNC4=C3C=C(C=C4)NS(=O)(=O)C)O

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)C(CN2CCC(CC2)C3=CNC4=C3C=C(C=C4)NS(=O)(=O)C)O

InChI

InChI=1S/C26H40N4O5S/c1-26(2,3)35-25(32)30-13-9-19(10-14-30)24(31)17-29-11-7-18(8-12-29)22-16-27-23-6-5-20(15-21(22)23)28-36(4,33)34/h5-6,15-16,18-19,24,27-28,31H,7-14,17H2,1-4H3