3-(heptylamino)-3-thiophen-2-yl-propanoic acid

Systemtic Name: 3-(heptylamino)-3-thiophen-2-yl-propanoic acid Openeye Name: 3-(heptylamino)-3-(2-thienyl)propanoic acid CAS Name: 3-(heptylamino)-3-thiophen-2-ylpropanoic acid IUPAC Name: 3-(heptylamino)-3-thiophen-2-ylpropanoic acid Traditional Name: 3-(heptylamino)-3-(2-thienyl)propionic acid Formula: C14H23NO2S MolecularWeight: 269.40292

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCNC(CC(=O)O)C1=CC=CS1

Isomeric SMILES

CCCCCCCNC(CC(=O)O)C1=CC=CS1

InChI

InChI=1S/C14H23NO2S/c1-2-3-4-5-6-9-15-12(11-14(16)17)13-8-7-10-18-13/h7-8,10,12,15H,2-6,9,11H2,1H3,(H,16,17)