4-[4-[1-[(4-bromophenyl)sulfonylamino]-3-phenyl-propyl]phenyl]butanoic acid

Systemtic Name: 4-[4-[1-[(4-bromophenyl)sulfonylamino]-3-phenyl-propyl]phenyl]butanoic acid Openeye Name: 4-[4-[1-[(4-bromophenyl)sulfonylamino]-3-phenyl-propyl]phenyl]butanoic acid CAS Name: 4-[4-[1-[(4-bromophenyl)sulfonylamino]-3-phenylpropyl]phenyl]butanoic acid IUPAC Name: 4-[4-[1-[(4-bromophenyl)sulfonylamino]-3-phenylpropyl]phenyl]butanoic acid Traditional Name: 4-[4-[1-(brosylamino)-3-phenyl-propyl]phenyl]butyric acid Formula: C25H26BrNO4S MolecularWeight: 516.44724

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCC(C2=CC=C(C=C2)CCCC(=O)O)NS(=O)(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

C1=CC=C(C=C1)CCC(C2=CC=C(C=C2)CCCC(=O)O)NS(=O)(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C25H26BrNO4S/c26-22-14-16-23(17-15-22)32(30,31)27-24(18-11-19-5-2-1-3-6-19)21-12-9-20(10-13-21)7-4-8-25(28)29/h1-3,5-6,9-10,12-17,24,27H,4,7-8,11,18H2,(H,28,29)