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2-methylprop-2-enyl 4-methylsulfonyl-3-nitro-benzoate

2-methylprop-2-enyl 4-methylsulfonyl-3-nitro-benzoate

Systemtic Name:2-methylprop-2-enyl 4-methylsulfonyl-3-nitro-benzoate
Openeye Name:2-methylallyl 4-methylsulfonyl-3-nitro-benzoate
CAS Name:4-methylsulfonyl-3-nitrobenzoic acid 2-methylprop-2-enyl ester
IUPAC Name:2-methylprop-2-enyl 4-methylsulfonyl-3-nitrobenzoate
Traditional Name:4-mesyl-3-nitro-benzoic acid 2-methylallyl ester
Formula: C12H13NO6S
MolecularWeight: 299.29972
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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)COC(=O)C1=CC(=C(C=C1)S(=O)(=O)C)[N+](=O)[O-]


Isomeric SMILES

CC(=C)COC(=O)C1=CC(=C(C=C1)S(=O)(=O)C)[N+](=O)[O-]


InChI

InChI=1S/C12H13NO6S/c1-8(2)7-19-12(14)9-4-5-11(20(3,17)18)10(6-9)13(15)16/h4-6H,1,7H2,2-3H3


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