2-chloranyl-5-[3-[4-(6-phenylhexoxy)phenyl]propanoylamino]benzoic acid

Systemtic Name: 2-chloranyl-5-[3-[4-(6-phenylhexoxy)phenyl]propanoylamino]benzoic acid Openeye Name: 2-chloro-5-[3-[4-(6-phenylhexoxy)phenyl]propanoylamino]benzoic acid CAS Name: 2-chloro-5-[[1-oxo-3-[4-(6-phenylhexoxy)phenyl]propyl]amino]benzoic acid IUPAC Name: 2-chloro-5-[3-[4-(6-phenylhexoxy)phenyl]propanoylamino]benzoic acid Traditional Name: 2-chloro-5-[3-[4-(6-phenylhexoxy)phenyl]propanoylamino]benzoic acid Formula: C28H30ClNO4 MolecularWeight: 479.9951

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCCCCOC2=CC=C(C=C2)CCC(=O)NC3=CC(=C(C=C3)Cl)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CCCCCCOC2=CC=C(C=C2)CCC(=O)NC3=CC(=C(C=C3)Cl)C(=O)O

InChI

InChI=1S/C28H30ClNO4/c29-26-17-14-23(20-25(26)28(32)33)30-27(31)18-13-22-11-15-24(16-12-22)34-19-7-2-1-4-8-21-9-5-3-6-10-21/h3,5-6,9-12,14-17,20H,1-2,4,7-8,13,18-19H2,(H,30,31)(H,32,33)