4-[2-[[4,5-bis(bromanyl)thiophen-2-yl]carbonylamino]ethyl]benzoic acid

Systemtic Name: 4-[2-[[4,5-bis(bromanyl)thiophen-2-yl]carbonylamino]ethyl]benzoic acid Openeye Name: 4-[2-[(4,5-dibromothiophene-2-carbonyl)amino]ethyl]benzoic acid CAS Name: 4-[2-[[(4,5-dibromo-2-thiophenyl)-oxomethyl]amino]ethyl]benzoic acid IUPAC Name: 4-[2-[(4,5-dibromothiophene-2-carbonyl)amino]ethyl]benzoic acid Traditional Name: 4-[2-[(4,5-dibromothiophene-2-carbonyl)amino]ethyl]benzoic acid Formula: C14H11Br2NO3S MolecularWeight: 433.11504

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CCNC(=O)C2=CC(=C(S2)Br)Br)C(=O)O

Isomeric SMILES

C1=CC(=CC=C1CCNC(=O)C2=CC(=C(S2)Br)Br)C(=O)O

InChI

InChI=1S/C14H11Br2NO3S/c15-10-7-11(21-12(10)16)13(18)17-6-5-8-1-3-9(4-2-8)14(19)20/h1-4,7H,5-6H2,(H,17,18)(H,19,20)