3-bromanyl-4-[2-(4-methoxyphenyl)-7-propyl-1H-indol-3-yl]pyrrole-2,5-dione

Systemtic Name: 3-bromanyl-4-[2-(4-methoxyphenyl)-7-propyl-1H-indol-3-yl]pyrrole-2,5-dione Openeye Name: 3-bromo-4-[2-(4-methoxyphenyl)-7-propyl-1H-indol-3-yl]pyrrole-2,5-dione CAS Name: 3-bromo-4-[2-(4-methoxyphenyl)-7-propyl-1H-indol-3-yl]pyrrole-2,5-dione IUPAC Name: 3-bromo-4-[2-(4-methoxyphenyl)-7-propyl-1H-indol-3-yl]pyrrole-2,5-dione Traditional Name: 3-bromo-4-[2-(4-methoxyphenyl)-7-propyl-1H-indol-3-yl]-3-pyrroline-2,5-quinone Formula: C22H19BrN2O3 MolecularWeight: 439.30186

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=CC2=C1NC(=C2C3=C(C(=O)NC3=O)Br)C4=CC=C(C=C4)OC

Isomeric SMILES

CCCC1=CC=CC2=C1NC(=C2C3=C(C(=O)NC3=O)Br)C4=CC=C(C=C4)OC

InChI

InChI=1S/C22H19BrN2O3/c1-3-5-12-6-4-7-15-16(17-18(23)22(27)25-21(17)26)20(24-19(12)15)13-8-10-14(28-2)11-9-13/h4,6-11,24H,3,5H2,1-2H3,(H,25,26,27)