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

Systemtic Name: 6-[[2-chloranyl-5-(5-chloranyl-1,3-benzoxazol-2-yl)phenyl]carbamoylamino]hexanoic acid Openeye Name: 6-[[2-chloro-5-(5-chloro-1,3-benzoxazol-2-yl)phenyl]carbamoylamino]hexanoic acid CAS Name: 6-[[[2-chloro-5-(5-chloro-1,3-benzoxazol-2-yl)anilino]-oxomethyl]amino]hexanoic acid IUPAC Name: 6-[[2-chloro-5-(5-chloro-1,3-benzoxazol-2-yl)phenyl]carbamoylamino]hexanoic acid Traditional Name: 6-[[2-chloro-5-(5-chloro-1,3-benzoxazol-2-yl)phenyl]carbamoylamino]hexanoic acid Formula: C20H19Cl2N3O4 MolecularWeight: 436.28856

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C2=NC3=C(O2)C=CC(=C3)Cl)NC(=O)NCCCCCC(=O)O)Cl

Isomeric SMILES

C1=CC(=C(C=C1C2=NC3=C(O2)C=CC(=C3)Cl)NC(=O)NCCCCCC(=O)O)Cl

InChI

InChI=1S/C20H19Cl2N3O4/c21-13-6-8-17-16(11-13)24-19(29-17)12-5-7-14(22)15(10-12)25-20(28)23-9-3-1-2-4-18(26)27/h5-8,10-11H,1-4,9H2,(H,26,27)(H2,23,25,28)