6-[methyl(thiophen-2-ylmethyl)amino]-3-oxidanylidene-hexanoate

Systemtic Name: 6-[methyl(thiophen-2-ylmethyl)amino]-3-oxidanylidene-hexanoate Openeye Name: 6-[methyl(2-thienylmethyl)amino]-3-oxo-hexanoate CAS Name: 6-[methyl(thiophen-2-ylmethyl)amino]-3-oxohexanoate IUPAC Name: 6-[methyl(thiophen-2-ylmethyl)amino]-3-oxohexanoate Traditional Name: 3-keto-6-[methyl(2-thenyl)amino]hexanoate Formula: C12H16NO3S- MolecularWeight: 254.32534

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCC(=O)CC(=O)[O-])CC1=CC=CS1

Isomeric SMILES

CN(CCCC(=O)CC(=O)[O-])CC1=CC=CS1

InChI

InChI=1S/C12H17NO3S/c1-13(9-11-5-3-7-17-11)6-2-4-10(14)8-12(15)16/h3,5,7H,2,4,6,8-9H2,1H3,(H,15,16)/p-1