6-[[3-(5-phenyl-1,3-benzoxazol-2-yl)phenyl]carbamoylamino]hexanoic acid

Systemtic Name: 6-[[3-(5-phenyl-1,3-benzoxazol-2-yl)phenyl]carbamoylamino]hexanoic acid Openeye Name: 6-[[3-(5-phenyl-1,3-benzoxazol-2-yl)phenyl]carbamoylamino]hexanoic acid CAS Name: 6-[[oxo-[3-(5-phenyl-1,3-benzoxazol-2-yl)anilino]methyl]amino]hexanoic acid IUPAC Name: 6-[[3-(5-phenyl-1,3-benzoxazol-2-yl)phenyl]carbamoylamino]hexanoic acid Traditional Name: 6-[[3-(5-phenyl-1,3-benzoxazol-2-yl)phenyl]carbamoylamino]hexanoic acid Formula: C26H25N3O4 MolecularWeight: 443.4944

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC3=C(C=C2)OC(=N3)C4=CC(=CC=C4)NC(=O)NCCCCCC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C2=CC3=C(C=C2)OC(=N3)C4=CC(=CC=C4)NC(=O)NCCCCCC(=O)O

InChI

InChI=1S/C26H25N3O4/c30-24(31)12-5-2-6-15-27-26(32)28-21-11-7-10-20(16-21)25-29-22-17-19(13-14-23(22)33-25)18-8-3-1-4-9-18/h1,3-4,7-11,13-14,16-17H,2,5-6,12,15H2,(H,30,31)(H2,27,28,32)