4-oxidanylidene-4-[(4-pyrrolidin-1-ylsulfonylphenyl)amino]butanoate

Systemtic Name: 4-oxidanylidene-4-[(4-pyrrolidin-1-ylsulfonylphenyl)amino]butanoate Openeye Name: 4-oxo-4-(4-pyrrolidin-1-ylsulfonylanilino)butanoate CAS Name: 4-oxo-4-[4-(1-pyrrolidinylsulfonyl)anilino]butanoate IUPAC Name: 4-oxo-4-(4-pyrrolidin-1-ylsulfonylanilino)butanoate Traditional Name: 4-keto-4-(4-pyrrolidinosulfonylanilino)butyrate Formula: C14H17N2O5S- MolecularWeight: 325.36018

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)CCC(=O)[O-]

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)CCC(=O)[O-]

InChI

InChI=1S/C14H18N2O5S/c17-13(7-8-14(18)19)15-11-3-5-12(6-4-11)22(20,21)16-9-1-2-10-16/h3-6H,1-2,7-10H2,(H,15,17)(H,18,19)/p-1