3-bromanyl-4-(2-butyl-1-methyl-indol-3-yl)pyrrole-2,5-dione

Systemtic Name: 3-bromanyl-4-(2-butyl-1-methyl-indol-3-yl)pyrrole-2,5-dione Openeye Name: 3-bromo-4-(2-butyl-1-methyl-indol-3-yl)pyrrole-2,5-dione CAS Name: 3-bromo-4-(2-butyl-1-methyl-3-indolyl)pyrrole-2,5-dione IUPAC Name: 3-bromo-4-(2-butyl-1-methylindol-3-yl)pyrrole-2,5-dione Traditional Name: 3-bromo-4-(2-butyl-1-methyl-indol-3-yl)-3-pyrroline-2,5-quinone Formula: C17H17BrN2O2 MolecularWeight: 361.23308

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C2=CC=CC=C2N1C)C3=C(C(=O)NC3=O)Br

Isomeric SMILES

CCCCC1=C(C2=CC=CC=C2N1C)C3=C(C(=O)NC3=O)Br

InChI

InChI=1S/C17H17BrN2O2/c1-3-4-8-12-13(14-15(18)17(22)19-16(14)21)10-7-5-6-9-11(10)20(12)2/h5-7,9H,3-4,8H2,1-2H3,(H,19,21,22)