3-(7-azanylheptanoylamino)-3-thiophen-2-yl-propanoic acid

Systemtic Name: 3-(7-azanylheptanoylamino)-3-thiophen-2-yl-propanoic acid Openeye Name: 3-(7-aminoheptanoylamino)-3-(2-thienyl)propanoic acid CAS Name: 3-[(7-amino-1-oxoheptyl)amino]-3-thiophen-2-ylpropanoic acid IUPAC Name: 3-(7-aminoheptanoylamino)-3-thiophen-2-ylpropanoic acid Traditional Name: 3-(7-aminoheptanoylamino)-3-(2-thienyl)propionic acid Formula: C14H22N2O3S MolecularWeight: 298.40108

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)C(CC(=O)O)NC(=O)CCCCCCN

Isomeric SMILES

C1=CSC(=C1)C(CC(=O)O)NC(=O)CCCCCCN

InChI

InChI=1S/C14H22N2O3S/c15-8-4-2-1-3-7-13(17)16-11(10-14(18)19)12-6-5-9-20-12/h5-6,9,11H,1-4,7-8,10,15H2,(H,16,17)(H,18,19)