2-[[4-[7-(5-ethylfuran-2-yl)hept-6-ynylamino]phenyl]carbonylamino]ethanoic acid

Systemtic Name: 2-[[4-[7-(5-ethylfuran-2-yl)hept-6-ynylamino]phenyl]carbonylamino]ethanoic acid Openeye Name: 2-[[4-[7-(5-ethyl-2-furyl)hept-6-ynylamino]benzoyl]amino]acetic acid CAS Name: 2-[[[4-[7-(5-ethyl-2-furanyl)hept-6-ynylamino]phenyl]-oxomethyl]amino]acetic acid IUPAC Name: 2-[[4-[7-(5-ethylfuran-2-yl)hept-6-ynylamino]benzoyl]amino]acetic acid Traditional Name: 2-[[4-[7-(5-ethyl-2-furyl)hept-6-ynylamino]benzoyl]amino]acetic acid Formula: C22H26N2O4 MolecularWeight: 382.45284

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(O1)C#CCCCCCNC2=CC=C(C=C2)C(=O)NCC(=O)O

Isomeric SMILES

CCC1=CC=C(O1)C#CCCCCCNC2=CC=C(C=C2)C(=O)NCC(=O)O

InChI

InChI=1S/C22H26N2O4/c1-2-19-13-14-20(28-19)8-6-4-3-5-7-15-23-18-11-9-17(10-12-18)22(27)24-16-21(25)26/h9-14,23H,2-5,7,15-16H2,1H3,(H,24,27)(H,25,26)