4-[(5-chloranylthiophen-2-yl)sulfonyl-ethyl-amino]butanoate

Systemtic Name: 4-[(5-chloranylthiophen-2-yl)sulfonyl-ethyl-amino]butanoate Openeye Name: 4-[(5-chloro-2-thienyl)sulfonyl-ethyl-amino]butanoate CAS Name: 4-[(5-chloro-2-thiophenyl)sulfonyl-ethylamino]butanoate IUPAC Name: 4-[(5-chlorothiophen-2-yl)sulfonyl-ethylamino]butanoate Traditional Name: 4-[(5-chloro-2-thienyl)sulfonyl-ethyl-amino]butyrate Formula: C10H13ClNO4S2- MolecularWeight: 310.79752

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CCCC(=O)[O-])S(=O)(=O)C1=CC=C(S1)Cl

Isomeric SMILES

CCN(CCCC(=O)[O-])S(=O)(=O)C1=CC=C(S1)Cl

InChI

InChI=1S/C10H14ClNO4S2/c1-2-12(7-3-4-9(13)14)18(15,16)10-6-5-8(11)17-10/h5-6H,2-4,7H2,1H3,(H,13,14)/p-1