tert-butyl 3-[4-(1H-indol-3-yl)-1-methyl-pyrrol-3-yl]indole-1-carboxylate

Systemtic Name: tert-butyl 3-[4-(1H-indol-3-yl)-1-methyl-pyrrol-3-yl]indole-1-carboxylate Openeye Name: tert-butyl 3-[4-(1H-indol-3-yl)-1-methyl-pyrrol-3-yl]indole-1-carboxylate CAS Name: 3-[4-(1H-indol-3-yl)-1-methyl-3-pyrrolyl]-1-indolecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-[4-(1H-indol-3-yl)-1-methylpyrrol-3-yl]indole-1-carboxylate Traditional Name: 3-[4-(1H-indol-3-yl)-1-methyl-pyrrol-3-yl]indole-1-carboxylic acid tert-butyl ester Formula: C26H25N3O2 MolecularWeight: 411.4956

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1C=C(C2=CC=CC=C21)C3=CN(C=C3C4=CNC5=CC=CC=C54)C

Isomeric SMILES

CC(C)(C)OC(=O)N1C=C(C2=CC=CC=C21)C3=CN(C=C3C4=CNC5=CC=CC=C54)C

InChI

InChI=1S/C26H25N3O2/c1-26(2,3)31-25(30)29-16-22(18-10-6-8-12-24(18)29)21-15-28(4)14-20(21)19-13-27-23-11-7-5-9-17(19)23/h5-16,27H,1-4H3