6-[methyl(thiophen-3-ylmethyl)amino]-6-oxidanylidene-hexanoic acid

Systemtic Name: 6-[methyl(thiophen-3-ylmethyl)amino]-6-oxidanylidene-hexanoic acid Openeye Name: 6-[methyl(3-thienylmethyl)amino]-6-oxo-hexanoic acid CAS Name: 6-[methyl(3-thiophenylmethyl)amino]-6-oxohexanoic acid IUPAC Name: 6-[methyl(thiophen-3-ylmethyl)amino]-6-oxohexanoic acid Traditional Name: 6-keto-6-[methyl(3-thenyl)amino]hexanoic acid Formula: C12H17NO3S MolecularWeight: 255.33328

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CSC=C1)C(=O)CCCCC(=O)O

Isomeric SMILES

CN(CC1=CSC=C1)C(=O)CCCCC(=O)O

InChI

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