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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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