3-[(3-aminocarbonylphenyl)methylsulfonyl]propanoate

Systemtic Name: 3-[(3-aminocarbonylphenyl)methylsulfonyl]propanoate Openeye Name: 3-[(3-carbamoylphenyl)methylsulfonyl]propanoate CAS Name: 3-[(3-carbamoylphenyl)methylsulfonyl]propanoate IUPAC Name: 3-[(3-carbamoylphenyl)methylsulfonyl]propanoate Traditional Name: 3-(3-carbamoylbenzyl)sulfonylpropionate Formula: C11H12NO5S- MolecularWeight: 270.28168

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)CS(=O)(=O)CCC(=O)[O-])C(=O)N

Isomeric SMILES

C1=CC(=CC(=C1)CS(=O)(=O)CCC(=O)[O-])C(=O)N

InChI

InChI=1S/C11H13NO5S/c12-11(15)9-3-1-2-8(6-9)7-18(16,17)5-4-10(13)14/h1-3,6H,4-5,7H2,(H2,12,15)(H,13,14)/p-1