4-[(2-chloranyl-5-cyano-phenyl)amino]butanoic acid

Systemtic Name: 4-[(2-chloranyl-5-cyano-phenyl)amino]butanoic acid Openeye Name: 4-(2-chloro-5-cyano-anilino)butanoic acid CAS Name: 4-(2-chloro-5-cyanoanilino)butanoic acid IUPAC Name: 4-(2-chloro-5-cyanoanilino)butanoic acid Traditional Name: 4-(2-chloro-5-cyano-anilino)butyric acid Formula: C11H11ClN2O2 MolecularWeight: 238.67024

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C#N)NCCCC(=O)O)Cl

Isomeric SMILES

C1=CC(=C(C=C1C#N)NCCCC(=O)O)Cl

InChI

InChI=1S/C11H11ClN2O2/c12-9-4-3-8(7-13)6-10(9)14-5-1-2-11(15)16/h3-4,6,14H,1-2,5H2,(H,15,16)