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thionitroso-[2-(3,4,5-trimethoxyphenyl)ethyl]carbamic acid

thionitroso-[2-(3,4,5-trimethoxyphenyl)ethyl]carbamic acid

Systemtic Name:thionitroso-[2-(3,4,5-trimethoxyphenyl)ethyl]carbamic acid
Openeye Name:thionitroso-[2-(3,4,5-trimethoxyphenyl)ethyl]carbamic acid
CAS Name:thionitroso-[2-(3,4,5-trimethoxyphenyl)ethyl]carbamic acid
IUPAC Name:thionitroso-[2-(3,4,5-trimethoxyphenyl)ethyl]carbamic acid
Traditional Name:thionitroso-[2-(3,4,5-trimethoxyphenyl)ethyl]carbamic acid
Formula: C12H16N2O5S
MolecularWeight: 300.33084
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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)CCN(C(=O)O)N=S


Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)CCN(C(=O)O)N=S


InChI

InChI=1S/C12H16N2O5S/c1-17-9-6-8(4-5-14(13-20)12(15)16)7-10(18-2)11(9)19-3/h6-7H,4-5H2,1-3H3,(H,15,16)


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