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ethyl (E)-4-(1H-indol-3-yl)-3-nitro-2-oxidanyl-but-3-enoate

ethyl (E)-4-(1H-indol-3-yl)-3-nitro-2-oxidanyl-but-3-enoate

Systemtic Name:ethyl (E)-4-(1H-indol-3-yl)-3-nitro-2-oxidanyl-but-3-enoate
Openeye Name:ethyl (E)-2-hydroxy-4-(1H-indol-3-yl)-3-nitro-but-3-enoate
CAS Name:(E)-2-hydroxy-4-(1H-indol-3-yl)-3-nitro-3-butenoic acid ethyl ester
IUPAC Name:ethyl (E)-2-hydroxy-4-(1H-indol-3-yl)-3-nitrobut-3-enoate
Traditional Name:(E)-2-hydroxy-4-(1H-indol-3-yl)-3-nitro-but-3-enoic acid ethyl ester
Formula: C14H14N2O5
MolecularWeight: 290.27136
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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(=CC1=CNC2=CC=CC=C21)[N+](=O)[O-])O


Isomeric SMILES

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


InChI

InChI=1S/C14H14N2O5/c1-2-21-14(18)13(17)12(16(19)20)7-9-8-15-11-6-4-3-5-10(9)11/h3-8,13,15,17H,2H2,1H3/b12-7+


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