5-bromanyl-1-[4-(2,5-dimethylphenoxy)butyl]indole-2,3-dione

Systemtic Name: 5-bromanyl-1-[4-(2,5-dimethylphenoxy)butyl]indole-2,3-dione Openeye Name: 5-bromo-1-[4-(2,5-dimethylphenoxy)butyl]indoline-2,3-dione CAS Name: 5-bromo-1-[4-(2,5-dimethylphenoxy)butyl]indole-2,3-dione IUPAC Name: 5-bromo-1-[4-(2,5-dimethylphenoxy)butyl]indole-2,3-dione Traditional Name: 5-bromo-1-[4-(2,5-dimethylphenoxy)butyl]isatin Formula: C20H20BrNO3 MolecularWeight: 402.2817

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)OCCCCN2C3=C(C=C(C=C3)Br)C(=O)C2=O

Isomeric SMILES

CC1=CC(=C(C=C1)C)OCCCCN2C3=C(C=C(C=C3)Br)C(=O)C2=O

InChI

InChI=1S/C20H20BrNO3/c1-13-5-6-14(2)18(11-13)25-10-4-3-9-22-17-8-7-15(21)12-16(17)19(23)20(22)24/h5-8,11-12H,3-4,9-10H2,1-2H3