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1-[(E)-3-chloranylbut-2-enyl]-7-methyl-5-nitro-indole-2,3-dione

1-[(E)-3-chloranylbut-2-enyl]-7-methyl-5-nitro-indole-2,3-dione

Systemtic Name:1-[(E)-3-chloranylbut-2-enyl]-7-methyl-5-nitro-indole-2,3-dione
Openeye Name:1-[(E)-3-chlorobut-2-enyl]-7-methyl-5-nitro-indoline-2,3-dione
CAS Name:1-[(E)-3-chlorobut-2-enyl]-7-methyl-5-nitroindole-2,3-dione
IUPAC Name:1-[(E)-3-chlorobut-2-enyl]-7-methyl-5-nitroindole-2,3-dione
Traditional Name:1-[(E)-3-chlorobut-2-enyl]-7-methyl-5-nitro-isatin
Formula: C13H11ClN2O4
MolecularWeight: 294.69044
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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC(=C1)[N+](=O)[O-])C(=O)C(=O)N2CC=C(C)Cl


Isomeric SMILES

CC1=C2C(=CC(=C1)[N+](=O)[O-])C(=O)C(=O)N2C/C=C(\C)/Cl


InChI

InChI=1S/C13H11ClN2O4/c1-7-5-9(16(19)20)6-10-11(7)15(4-3-8(2)14)13(18)12(10)17/h3,5-6H,4H2,1-2H3/b8-3+


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