2-[[5-(5-chloranyl-1,3-benzoxazol-2-yl)pyrimidin-2-yl]amino]benzoic acid

Systemtic Name: 2-[[5-(5-chloranyl-1,3-benzoxazol-2-yl)pyrimidin-2-yl]amino]benzoic acid Openeye Name: 2-[[5-(5-chloro-1,3-benzoxazol-2-yl)pyrimidin-2-yl]amino]benzoic acid CAS Name: 2-[[5-(5-chloro-1,3-benzoxazol-2-yl)-2-pyrimidinyl]amino]benzoic acid IUPAC Name: 2-[[5-(5-chloro-1,3-benzoxazol-2-yl)pyrimidin-2-yl]amino]benzoic acid Traditional Name: 2-[[5-(5-chloro-1,3-benzoxazol-2-yl)pyrimidin-2-yl]amino]benzoic acid Formula: C18H11ClN4O3 MolecularWeight: 366.75794

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)O)NC2=NC=C(C=N2)C3=NC4=C(O3)C=CC(=C4)Cl

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)O)NC2=NC=C(C=N2)C3=NC4=C(O3)C=CC(=C4)Cl

InChI

InChI=1S/C18H11ClN4O3/c19-11-5-6-15-14(7-11)22-16(26-15)10-8-20-18(21-9-10)23-13-4-2-1-3-12(13)17(24)25/h1-9H,(H,24,25)(H,20,21,23)