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

Systemtic Name: 3-bromanyl-4-[5-hexyl-2-(3-methoxyphenyl)-1H-indol-3-yl]pyrrole-2,5-dione Openeye Name: 3-bromo-4-[5-hexyl-2-(3-methoxyphenyl)-1H-indol-3-yl]pyrrole-2,5-dione CAS Name: 3-bromo-4-[5-hexyl-2-(3-methoxyphenyl)-1H-indol-3-yl]pyrrole-2,5-dione IUPAC Name: 3-bromo-4-[5-hexyl-2-(3-methoxyphenyl)-1H-indol-3-yl]pyrrole-2,5-dione Traditional Name: 3-bromo-4-[5-hexyl-2-(3-methoxyphenyl)-1H-indol-3-yl]-3-pyrroline-2,5-quinone Formula: C25H25BrN2O3 MolecularWeight: 481.3816

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC2=C(C=C1)NC(=C2C3=C(C(=O)NC3=O)Br)C4=CC(=CC=C4)OC

Isomeric SMILES

CCCCCCC1=CC2=C(C=C1)NC(=C2C3=C(C(=O)NC3=O)Br)C4=CC(=CC=C4)OC

InChI

InChI=1S/C25H25BrN2O3/c1-3-4-5-6-8-15-11-12-19-18(13-15)20(21-22(26)25(30)28-24(21)29)23(27-19)16-9-7-10-17(14-16)31-2/h7,9-14,27H,3-6,8H2,1-2H3,(H,28,29,30)