2-[2-[2,3-bis(chloranyl)-4-(2-methylidenebutanoyl)phenoxy]ethanoylamino]-3-phenyl-propanoic acid

Systemtic Name: 2-[2-[2,3-bis(chloranyl)-4-(2-methylidenebutanoyl)phenoxy]ethanoylamino]-3-phenyl-propanoic acid Openeye Name: 2-[[2-[2,3-dichloro-4-(2-methylenebutanoyl)phenoxy]acetyl]amino]-3-phenyl-propanoic acid CAS Name: 2-[[2-[2,3-dichloro-4-(2-methylene-1-oxobutyl)phenoxy]-1-oxoethyl]amino]-3-phenylpropanoic acid IUPAC Name: 2-[[2-[2,3-dichloro-4-(2-methylidenebutanoyl)phenoxy]acetyl]amino]-3-phenylpropanoic acid Traditional Name: 2-[[2-[2,3-dichloro-4-(2-ethylacryloyl)phenoxy]acetyl]amino]-3-phenyl-propionic acid Formula: C22H21Cl2NO5 MolecularWeight: 450.31184

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(=C)C(=O)C1=C(C(=C(C=C1)OCC(=O)NC(CC2=CC=CC=C2)C(=O)O)Cl)Cl

Isomeric SMILES

CCC(=C)C(=O)C1=C(C(=C(C=C1)OCC(=O)NC(CC2=CC=CC=C2)C(=O)O)Cl)Cl

InChI

InChI=1S/C22H21Cl2NO5/c1-3-13(2)21(27)15-9-10-17(20(24)19(15)23)30-12-18(26)25-16(22(28)29)11-14-7-5-4-6-8-14/h4-10,16H,2-3,11-12H2,1H3,(H,25,26)(H,28,29)