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(4-methoxycarbonylphenyl)methyl 4-methylsulfanyl-3-nitro-benzoate

(4-methoxycarbonylphenyl)methyl 4-methylsulfanyl-3-nitro-benzoate

Systemtic Name:(4-methoxycarbonylphenyl)methyl 4-methylsulfanyl-3-nitro-benzoate
Openeye Name:(4-methoxycarbonylphenyl)methyl 4-methylsulfanyl-3-nitro-benzoate
CAS Name:4-(methylthio)-3-nitrobenzoic acid (4-methoxycarbonylphenyl)methyl ester
IUPAC Name:(4-methoxycarbonylphenyl)methyl 4-methylsulfanyl-3-nitrobenzoate
Traditional Name:4-(methylthio)-3-nitro-benzoic acid (4-carbomethoxybenzyl) ester
Formula: C17H15NO6S
MolecularWeight: 361.3691
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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)COC(=O)C2=CC(=C(C=C2)SC)[N+](=O)[O-]


Isomeric SMILES

COC(=O)C1=CC=C(C=C1)COC(=O)C2=CC(=C(C=C2)SC)[N+](=O)[O-]


InChI

InChI=1S/C17H15NO6S/c1-23-16(19)12-5-3-11(4-6-12)10-24-17(20)13-7-8-15(25-2)14(9-13)18(21)22/h3-9H,10H2,1-2H3


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