4-[(5-ethylthiophen-2-yl)carbonyl-methyl-amino]butanoic acid

Systemtic Name: 4-[(5-ethylthiophen-2-yl)carbonyl-methyl-amino]butanoic acid Openeye Name: 4-[(5-ethylthiophene-2-carbonyl)-methyl-amino]butanoic acid CAS Name: 4-[[(5-ethyl-2-thiophenyl)-oxomethyl]-methylamino]butanoic acid IUPAC Name: 4-[(5-ethylthiophene-2-carbonyl)-methylamino]butanoic acid Traditional Name: 4-[(5-ethylthiophene-2-carbonyl)-methyl-amino]butyric acid Formula: C12H17NO3S MolecularWeight: 255.33328

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(S1)C(=O)N(C)CCCC(=O)O

Isomeric SMILES

CCC1=CC=C(S1)C(=O)N(C)CCCC(=O)O

InChI

InChI=1S/C12H17NO3S/c1-3-9-6-7-10(17-9)12(16)13(2)8-4-5-11(14)15/h6-7H,3-5,8H2,1-2H3,(H,14,15)