5-bromanyl-7-methyl-1-pentyl-indole-2,3-dione

Systemtic Name: 5-bromanyl-7-methyl-1-pentyl-indole-2,3-dione Openeye Name: 5-bromo-7-methyl-1-pentyl-indoline-2,3-dione CAS Name: 5-bromo-7-methyl-1-pentylindole-2,3-dione IUPAC Name: 5-bromo-7-methyl-1-pentylindole-2,3-dione Traditional Name: 1-amyl-5-bromo-7-methyl-isatin Formula: C14H16BrNO2 MolecularWeight: 310.18634

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C2=C(C=C(C=C2C(=O)C1=O)Br)C

Isomeric SMILES

CCCCCN1C2=C(C=C(C=C2C(=O)C1=O)Br)C

InChI

InChI=1S/C14H16BrNO2/c1-3-4-5-6-16-12-9(2)7-10(15)8-11(12)13(17)14(16)18/h7-8H,3-6H2,1-2H3