3-[4-isocyano-2-(2-naphthalen-1-ylpropanoylamino)phenyl]propanoic acid

Systemtic Name: 3-[4-isocyano-2-(2-naphthalen-1-ylpropanoylamino)phenyl]propanoic acid Openeye Name: 3-[4-isocyano-2-[2-(1-naphthyl)propanoylamino]phenyl]propanoic acid CAS Name: 3-[4-isocyano-2-[[2-(1-naphthalenyl)-1-oxopropyl]amino]phenyl]propanoic acid IUPAC Name: 3-[4-isocyano-2-(2-naphthalen-1-ylpropanoylamino)phenyl]propanoic acid Traditional Name: 3-[4-isocyano-2-[2-(1-naphthyl)propanoylamino]phenyl]propionic acid Formula: C23H20N2O3 MolecularWeight: 372.4165

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC2=CC=CC=C21)C(=O)NC3=C(C=CC(=C3)[N+]#[C-])CCC(=O)O

Isomeric SMILES

CC(C1=CC=CC2=CC=CC=C21)C(=O)NC3=C(C=CC(=C3)[N+]#[C-])CCC(=O)O

InChI

InChI=1S/C23H20N2O3/c1-15(19-9-5-7-16-6-3-4-8-20(16)19)23(28)25-21-14-18(24-2)12-10-17(21)11-13-22(26)27/h3-10,12,14-15H,11,13H2,1H3,(H,25,28)(H,26,27)