tert-butyl 3-[4-bromanyl-1-[(2-methylpropan-2-yl)oxycarbonyl]-2,5-bis(oxidanylidene)pyrrol-3-yl]-6-phenylmethoxy-indole-1-carboxylate

Systemtic Name: tert-butyl 3-[4-bromanyl-1-[(2-methylpropan-2-yl)oxycarbonyl]-2,5-bis(oxidanylidene)pyrrol-3-yl]-6-phenylmethoxy-indole-1-carboxylate Openeye Name: tert-butyl 6-benzyloxy-3-(4-bromo-1-tert-butoxycarbonyl-2,5-dioxo-pyrrol-3-yl)indole-1-carboxylate CAS Name: 3-[4-bromo-1-[(2-methylpropan-2-yl)oxy-oxomethyl]-2,5-dioxo-3-pyrrolyl]-6-phenylmethoxy-1-indolecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-[4-bromo-1-[(2-methylpropan-2-yl)oxycarbonyl]-2,5-dioxopyrrol-3-yl]-6-phenylmethoxyindole-1-carboxylate Traditional Name: 6-benzoxy-3-(4-bromo-1-tert-butoxycarbonyl-2,5-diketo-3-pyrrolin-3-yl)indole-1-carboxylic acid tert-butyl ester Formula: C29H29BrN2O7 MolecularWeight: 597.45376

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1C=C(C2=C1C=C(C=C2)OCC3=CC=CC=C3)C4=C(C(=O)N(C4=O)C(=O)OC(C)(C)C)Br

Isomeric SMILES

CC(C)(C)OC(=O)N1C=C(C2=C1C=C(C=C2)OCC3=CC=CC=C3)C4=C(C(=O)N(C4=O)C(=O)OC(C)(C)C)Br

InChI

InChI=1S/C29H29BrN2O7/c1-28(2,3)38-26(35)31-15-20(22-23(30)25(34)32(24(22)33)27(36)39-29(4,5)6)19-13-12-18(14-21(19)31)37-16-17-10-8-7-9-11-17/h7-15H,16H2,1-6H3