2-isocyanato-3-(4-thiophen-2-ylphenyl)propanoic acid

Systemtic Name: 2-isocyanato-3-(4-thiophen-2-ylphenyl)propanoic acid Openeye Name: 2-isocyanato-3-[4-(2-thienyl)phenyl]propanoic acid CAS Name: 2-isocyanato-3-(4-thiophen-2-ylphenyl)propanoic acid IUPAC Name: 2-isocyanato-3-(4-thiophen-2-ylphenyl)propanoic acid Traditional Name: 2-isocyanato-3-[4-(2-thienyl)phenyl]propionic acid Formula: C14H11NO3S MolecularWeight: 273.30704

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)C2=CC=C(C=C2)CC(C(=O)O)N=C=O

Isomeric SMILES

C1=CSC(=C1)C2=CC=C(C=C2)CC(C(=O)O)N=C=O

InChI

InChI=1S/C14H11NO3S/c16-9-15-12(14(17)18)8-10-3-5-11(6-4-10)13-2-1-7-19-13/h1-7,12H,8H2,(H,17,18)