tert-butyl 3-[1-(phenylsulfonyl)indol-2-yl]indole-1-carboxylate

Systemtic Name: tert-butyl 3-[1-(phenylsulfonyl)indol-2-yl]indole-1-carboxylate Openeye Name: tert-butyl 3-[1-(benzenesulfonyl)indol-2-yl]indole-1-carboxylate CAS Name: 3-[1-(benzenesulfonyl)-2-indolyl]-1-indolecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-[1-(benzenesulfonyl)indol-2-yl]indole-1-carboxylate Traditional Name: 3-(1-besylindol-2-yl)indole-1-carboxylic acid tert-butyl ester Formula: C27H24N2O4S MolecularWeight: 472.55546

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1C=C(C2=CC=CC=C21)C3=CC4=CC=CC=C4N3S(=O)(=O)C5=CC=CC=C5

Isomeric SMILES

CC(C)(C)OC(=O)N1C=C(C2=CC=CC=C21)C3=CC4=CC=CC=C4N3S(=O)(=O)C5=CC=CC=C5

InChI

InChI=1S/C27H24N2O4S/c1-27(2,3)33-26(30)28-18-22(21-14-8-10-16-24(21)28)25-17-19-11-7-9-15-23(19)29(25)34(31,32)20-12-5-4-6-13-20/h4-18H,1-3H3