methyl 2-(2-azanyl-2-oxidanylidene-ethoxy)-5-pyrrolidin-1-ylsulfonyl-benzoate

Systemtic Name: methyl 2-(2-azanyl-2-oxidanylidene-ethoxy)-5-pyrrolidin-1-ylsulfonyl-benzoate Openeye Name: methyl 2-(2-amino-2-oxo-ethoxy)-5-pyrrolidin-1-ylsulfonyl-benzoate CAS Name: 2-(2-amino-2-oxoethoxy)-5-(1-pyrrolidinylsulfonyl)benzoic acid methyl ester IUPAC Name: methyl 2-(2-amino-2-oxoethoxy)-5-pyrrolidin-1-ylsulfonylbenzoate Traditional Name: 2-(2-amino-2-keto-ethoxy)-5-pyrrolidinosulfonyl-benzoic acid methyl ester Formula: C14H18N2O6S MolecularWeight: 342.36752

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=CC(=C1)S(=O)(=O)N2CCCC2)OCC(=O)N

Isomeric SMILES

COC(=O)C1=C(C=CC(=C1)S(=O)(=O)N2CCCC2)OCC(=O)N

InChI

InChI=1S/C14H18N2O6S/c1-21-14(18)11-8-10(4-5-12(11)22-9-13(15)17)23(19,20)16-6-2-3-7-16/h4-5,8H,2-3,6-7,9H2,1H3,(H2,15,17)