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methyl 3-[(2-azanyl-2-oxidanylidene-ethyl)sulfanylmethyl]benzoate

methyl 3-[(2-azanyl-2-oxidanylidene-ethyl)sulfanylmethyl]benzoate

Systemtic Name:methyl 3-[(2-azanyl-2-oxidanylidene-ethyl)sulfanylmethyl]benzoate
Openeye Name:methyl 3-[(2-amino-2-oxo-ethyl)sulfanylmethyl]benzoate
CAS Name:3-[[(2-amino-2-oxoethyl)thio]methyl]benzoic acid methyl ester
IUPAC Name:methyl 3-[(2-amino-2-oxoethyl)sulfanylmethyl]benzoate
Traditional Name:3-[[(2-amino-2-keto-ethyl)thio]methyl]benzoic acid methyl ester
Formula: C11H13NO3S
MolecularWeight: 239.29082
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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC=C1)CSCC(=O)N


Isomeric SMILES

COC(=O)C1=CC(=CC=C1)CSCC(=O)N


InChI

InChI=1S/C11H13NO3S/c1-15-11(14)9-4-2-3-8(5-9)6-16-7-10(12)13/h2-5H,6-7H2,1H3,(H2,12,13)


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