4-[[2-methoxy-5-(5-phenyl-1,3-benzoxazol-2-yl)phenyl]carbamoylamino]butanoic acid

Systemtic Name: 4-[[2-methoxy-5-(5-phenyl-1,3-benzoxazol-2-yl)phenyl]carbamoylamino]butanoic acid Openeye Name: 4-[[2-methoxy-5-(5-phenyl-1,3-benzoxazol-2-yl)phenyl]carbamoylamino]butanoic acid CAS Name: 4-[[[2-methoxy-5-(5-phenyl-1,3-benzoxazol-2-yl)anilino]-oxomethyl]amino]butanoic acid IUPAC Name: 4-[[2-methoxy-5-(5-phenyl-1,3-benzoxazol-2-yl)phenyl]carbamoylamino]butanoic acid Traditional Name: 4-[[2-methoxy-5-(5-phenyl-1,3-benzoxazol-2-yl)phenyl]carbamoylamino]butyric acid Formula: C25H23N3O5 MolecularWeight: 445.46722

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NC3=C(O2)C=CC(=C3)C4=CC=CC=C4)NC(=O)NCCCC(=O)O

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NC3=C(O2)C=CC(=C3)C4=CC=CC=C4)NC(=O)NCCCC(=O)O

InChI

InChI=1S/C25H23N3O5/c1-32-21-11-10-18(15-19(21)28-25(31)26-13-5-8-23(29)30)24-27-20-14-17(9-12-22(20)33-24)16-6-3-2-4-7-16/h2-4,6-7,9-12,14-15H,5,8,13H2,1H3,(H,29,30)(H2,26,28,31)