4-[4-[(3-bromophenyl)carbonylamino]phenyl]butanoic acid

Systemtic Name: 4-[4-[(3-bromophenyl)carbonylamino]phenyl]butanoic acid Openeye Name: 4-[4-[(3-bromobenzoyl)amino]phenyl]butanoic acid CAS Name: 4-[4-[[(3-bromophenyl)-oxomethyl]amino]phenyl]butanoic acid IUPAC Name: 4-[4-[(3-bromobenzoyl)amino]phenyl]butanoic acid Traditional Name: 4-[4-[(3-bromobenzoyl)amino]phenyl]butyric acid Formula: C17H16BrNO3 MolecularWeight: 362.21784

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Br)C(=O)NC2=CC=C(C=C2)CCCC(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)Br)C(=O)NC2=CC=C(C=C2)CCCC(=O)O

InChI

InChI=1S/C17H16BrNO3/c18-14-5-2-4-13(11-14)17(22)19-15-9-7-12(8-10-15)3-1-6-16(20)21/h2,4-5,7-11H,1,3,6H2,(H,19,22)(H,20,21)