3-bromanyl-4-[2-(4-decoxyphenyl)-1H-indol-3-yl]pyrrole-2,5-dione

Systemtic Name: 3-bromanyl-4-[2-(4-decoxyphenyl)-1H-indol-3-yl]pyrrole-2,5-dione Openeye Name: 3-bromo-4-[2-(4-decoxyphenyl)-1H-indol-3-yl]pyrrole-2,5-dione CAS Name: 3-bromo-4-[2-(4-decoxyphenyl)-1H-indol-3-yl]pyrrole-2,5-dione IUPAC Name: 3-bromo-4-[2-(4-decoxyphenyl)-1H-indol-3-yl]pyrrole-2,5-dione Traditional Name: 3-bromo-4-[2-(4-decoxyphenyl)-1H-indol-3-yl]-3-pyrroline-2,5-quinone Formula: C28H31BrN2O3 MolecularWeight: 523.46134

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOC1=CC=C(C=C1)C2=C(C3=CC=CC=C3N2)C4=C(C(=O)NC4=O)Br

Isomeric SMILES

CCCCCCCCCCOC1=CC=C(C=C1)C2=C(C3=CC=CC=C3N2)C4=C(C(=O)NC4=O)Br

InChI

InChI=1S/C28H31BrN2O3/c1-2-3-4-5-6-7-8-11-18-34-20-16-14-19(15-17-20)26-23(21-12-9-10-13-22(21)30-26)24-25(29)28(33)31-27(24)32/h9-10,12-17,30H,2-8,11,18H2,1H3,(H,31,32,33)