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cyanomethyl 3-methyl-5-nitro-benzoate

cyanomethyl 3-methyl-5-nitro-benzoate

Systemtic Name:cyanomethyl 3-methyl-5-nitro-benzoate
Openeye Name:cyanomethyl 3-methyl-5-nitro-benzoate
CAS Name:3-methyl-5-nitrobenzoic acid cyanomethyl ester
IUPAC Name:cyanomethyl 3-methyl-5-nitrobenzoate
Traditional Name:3-methyl-5-nitro-benzoic acid cyanomethyl ester
Formula: C10H8N2O4
MolecularWeight: 220.18152
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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)C(=O)OCC#N)[N+](=O)[O-]


Isomeric SMILES

CC1=CC(=CC(=C1)C(=O)OCC#N)[N+](=O)[O-]


InChI

InChI=1S/C10H8N2O4/c1-7-4-8(10(13)16-3-2-11)6-9(5-7)12(14)15/h4-6H,3H2,1H3


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