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4-bromanyl-1-(2-diethylaminoethyl)indole-2,3-dione; 1H-indole-2,3-dione

4-bromanyl-1-(2-diethylaminoethyl)indole-2,3-dione; 1H-indole-2,3-dione

Systemtic Name:4-bromanyl-1-(2-diethylaminoethyl)indole-2,3-dione; 1H-indole-2,3-dione
Openeye Name:4-bromo-1-(2-diethylaminoethyl)indoline-2,3-dione; indoline-2,3-dione
CAS Name:4-bromo-1-(2-diethylaminoethyl)indole-2,3-dione; 1H-indole-2,3-dione
IUPAC Name:4-bromo-1-(2-diethylaminoethyl)indole-2,3-dione; 1H-indole-2,3-dione
Traditional Name:4-bromo-1-(2-diethylaminoethyl)isatin; isatin
Formula: C22H22BrN3O4
MolecularWeight: 472.33178
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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCN1C2=C(C(=CC=C2)Br)C(=O)C1=O.C1=CC=C2C(=C1)C(=O)C(=O)N2


Isomeric SMILES

CCN(CC)CCN1C2=C(C(=CC=C2)Br)C(=O)C1=O.C1=CC=C2C(=C1)C(=O)C(=O)N2


InChI

InChI=1S/C14H17BrN2O2.C8H5NO2/c1-3-16(4-2)8-9-17-11-7-5-6-10(15)12(11)13(18)14(17)19;10-7-5-3-1-2-4-6(5)9-8(7)11/h5-7H,3-4,8-9H2,1-2H3;1-4H,(H,9,10,11)


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