2-[2-(cyclopropylmethylamino)-2-oxidanylidene-ethyl]sulfonylbenzoic acid

Systemtic Name: 2-[2-(cyclopropylmethylamino)-2-oxidanylidene-ethyl]sulfonylbenzoic acid Openeye Name: 2-[2-(cyclopropylmethylamino)-2-oxo-ethyl]sulfonylbenzoic acid CAS Name: 2-[2-(cyclopropylmethylamino)-2-oxoethyl]sulfonylbenzoic acid IUPAC Name: 2-[2-(cyclopropylmethylamino)-2-oxoethyl]sulfonylbenzoic acid Traditional Name: 2-[2-(cyclopropylmethylamino)-2-keto-ethyl]sulfonylbenzoic acid Formula: C13H15NO5S MolecularWeight: 297.3269

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1CNC(=O)CS(=O)(=O)C2=CC=CC=C2C(=O)O

Isomeric SMILES

C1CC1CNC(=O)CS(=O)(=O)C2=CC=CC=C2C(=O)O

InChI

InChI=1S/C13H15NO5S/c15-12(14-7-9-5-6-9)8-20(18,19)11-4-2-1-3-10(11)13(16)17/h1-4,9H,5-8H2,(H,14,15)(H,16,17)