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3-(1H-indol-3-yl)-2-nitro-butanoate

3-(1H-indol-3-yl)-2-nitro-butanoate

Systemtic Name:3-(1H-indol-3-yl)-2-nitro-butanoate
Openeye Name:3-(1H-indol-3-yl)-2-nitro-butanoate
CAS Name:3-(1H-indol-3-yl)-2-nitrobutanoate
IUPAC Name:3-(1H-indol-3-yl)-2-nitrobutanoate
Traditional Name:3-(1H-indol-3-yl)-2-nitro-butyrate
Formula: C12H11N2O4-
MolecularWeight: 247.22674
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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CNC2=CC=CC=C21)C(C(=O)[O-])[N+](=O)[O-]


Isomeric SMILES

CC(C1=CNC2=CC=CC=C21)C(C(=O)[O-])[N+](=O)[O-]


InChI

InChI=1S/C12H12N2O4/c1-7(11(12(15)16)14(17)18)9-6-13-10-5-3-2-4-8(9)10/h2-7,11,13H,1H3,(H,15,16)/p-1


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