5-bromanyl-1-[3-(4-tert-butylphenoxy)propyl]indole-2,3-dione

Systemtic Name: 5-bromanyl-1-[3-(4-tert-butylphenoxy)propyl]indole-2,3-dione Openeye Name: 5-bromo-1-[3-(4-tert-butylphenoxy)propyl]indoline-2,3-dione CAS Name: 5-bromo-1-[3-(4-tert-butylphenoxy)propyl]indole-2,3-dione IUPAC Name: 5-bromo-1-[3-(4-tert-butylphenoxy)propyl]indole-2,3-dione Traditional Name: 5-bromo-1-[3-(4-tert-butylphenoxy)propyl]isatin Formula: C21H22BrNO3 MolecularWeight: 416.30828

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)OCCCN2C3=C(C=C(C=C3)Br)C(=O)C2=O

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)OCCCN2C3=C(C=C(C=C3)Br)C(=O)C2=O

InChI

InChI=1S/C21H22BrNO3/c1-21(2,3)14-5-8-16(9-6-14)26-12-4-11-23-18-10-7-15(22)13-17(18)19(24)20(23)25/h5-10,13H,4,11-12H2,1-3H3