2-[[4-(4-bromophenyl)phenyl]sulfonylamino]-6-(naphthalen-2-ylsulfonylamino)hexanoic acid

Systemtic Name: 2-[[4-(4-bromophenyl)phenyl]sulfonylamino]-6-(naphthalen-2-ylsulfonylamino)hexanoic acid Openeye Name: 2-[[4-(4-bromophenyl)phenyl]sulfonylamino]-6-(2-naphthylsulfonylamino)hexanoic acid CAS Name: 2-[[4-(4-bromophenyl)phenyl]sulfonylamino]-6-(2-naphthalenylsulfonylamino)hexanoic acid IUPAC Name: 2-[[4-(4-bromophenyl)phenyl]sulfonylamino]-6-(naphthalen-2-ylsulfonylamino)hexanoic acid Traditional Name: 2-[[4-(4-bromophenyl)phenyl]sulfonylamino]-6-(2-naphthylsulfonylamino)hexanoic acid Formula: C28H27BrN2O6S2 MolecularWeight: 631.55778

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=C(C=CC2=C1)S(=O)(=O)NCCCCC(C(=O)O)NS(=O)(=O)C3=CC=C(C=C3)C4=CC=C(C=C4)Br

Isomeric SMILES

C1=CC=C2C=C(C=CC2=C1)S(=O)(=O)NCCCCC(C(=O)O)NS(=O)(=O)C3=CC=C(C=C3)C4=CC=C(C=C4)Br

InChI

InChI=1S/C28H27BrN2O6S2/c29-24-13-8-21(9-14-24)22-10-15-25(16-11-22)39(36,37)31-27(28(32)33)7-3-4-18-30-38(34,35)26-17-12-20-5-1-2-6-23(20)19-26/h1-2,5-6,8-17,19,27,30-31H,3-4,7,18H2,(H,32,33)