2-[methyl-[(Z)-3-phenyl-5-thiophen-3-yl-pent-2-en-4-ynyl]amino]ethanoic acid

Systemtic Name: 2-[methyl-[(Z)-3-phenyl-5-thiophen-3-yl-pent-2-en-4-ynyl]amino]ethanoic acid Openeye Name: 2-[methyl-[(Z)-3-phenyl-5-(3-thienyl)pent-2-en-4-ynyl]amino]acetic acid CAS Name: 2-[methyl-[(Z)-3-phenyl-5-(3-thiophenyl)pent-2-en-4-ynyl]amino]acetic acid IUPAC Name: 2-[methyl-[(Z)-3-phenyl-5-thiophen-3-ylpent-2-en-4-ynyl]amino]acetic acid Traditional Name: 2-[methyl-[(Z)-3-phenyl-5-(3-thienyl)pent-2-en-4-ynyl]amino]acetic acid Formula: C18H17NO2S MolecularWeight: 311.39808

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CC=C(C#CC1=CSC=C1)C2=CC=CC=C2)CC(=O)O

Isomeric SMILES

CN(C/C=C(\C#CC1=CSC=C1)/C2=CC=CC=C2)CC(=O)O

InChI

InChI=1S/C18H17NO2S/c1-19(13-18(20)21)11-9-17(16-5-3-2-4-6-16)8-7-15-10-12-22-14-15/h2-6,9-10,12,14H,11,13H2,1H3,(H,20,21)/b17-9+