4-[[2,5-bis(chloranyl)phenyl]amino]butanoate

Systemtic Name: 4-[[2,5-bis(chloranyl)phenyl]amino]butanoate Openeye Name: 4-(2,5-dichloroanilino)butanoate CAS Name: 4-(2,5-dichloroanilino)butanoate IUPAC Name: 4-(2,5-dichloroanilino)butanoate Traditional Name: 4-(2,5-dichloroanilino)butyrate Formula: C10H10Cl2NO2- MolecularWeight: 247.0979

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1Cl)NCCCC(=O)[O-])Cl

Isomeric SMILES

C1=CC(=C(C=C1Cl)NCCCC(=O)[O-])Cl

InChI

InChI=1S/C10H11Cl2NO2/c11-7-3-4-8(12)9(6-7)13-5-1-2-10(14)15/h3-4,6,13H,1-2,5H2,(H,14,15)/p-1