3-[2-(4-acetamidobutanoyl)-5-chloranyl-phenyl]propanoic acid

Systemtic Name: 3-[2-(4-acetamidobutanoyl)-5-chloranyl-phenyl]propanoic acid Openeye Name: 3-[2-(4-acetamidobutanoyl)-5-chloro-phenyl]propanoic acid CAS Name: 3-[2-(4-acetamido-1-oxobutyl)-5-chlorophenyl]propanoic acid IUPAC Name: 3-[2-(4-acetamidobutanoyl)-5-chlorophenyl]propanoic acid Traditional Name: 3-[2-(4-acetamidobutanoyl)-5-chloro-phenyl]propionic acid Formula: C15H18ClNO4 MolecularWeight: 311.76072

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCCCC(=O)C1=C(C=C(C=C1)Cl)CCC(=O)O

Isomeric SMILES

CC(=O)NCCCC(=O)C1=C(C=C(C=C1)Cl)CCC(=O)O

InChI

InChI=1S/C15H18ClNO4/c1-10(18)17-8-2-3-14(19)13-6-5-12(16)9-11(13)4-7-15(20)21/h5-6,9H,2-4,7-8H2,1H3,(H,17,18)(H,20,21)