5-(hexanoylamino)-3-methyl-thiophene-2-carboxylate

Systemtic Name: 5-(hexanoylamino)-3-methyl-thiophene-2-carboxylate Openeye Name: 5-(hexanoylamino)-3-methyl-thiophene-2-carboxylate CAS Name: 3-methyl-5-(1-oxohexylamino)-2-thiophenecarboxylate IUPAC Name: 5-(hexanoylamino)-3-methylthiophene-2-carboxylate Traditional Name: 5-(caproylamino)-3-methyl-2-thenoate Formula: C12H16NO3S- MolecularWeight: 254.32534

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)NC1=CC(=C(S1)C(=O)[O-])C

Isomeric SMILES

CCCCCC(=O)NC1=CC(=C(S1)C(=O)[O-])C

InChI

InChI=1S/C12H17NO3S/c1-3-4-5-6-9(14)13-10-7-8(2)11(17-10)12(15)16/h7H,3-6H2,1-2H3,(H,13,14)(H,15,16)/p-1