5-[[2-(5-chloranyl-1,3-benzoxazol-2-yl)phenyl]amino]-5-oxidanylidene-pentanoic acid

Systemtic Name: 5-[[2-(5-chloranyl-1,3-benzoxazol-2-yl)phenyl]amino]-5-oxidanylidene-pentanoic acid Openeye Name: 5-[2-(5-chloro-1,3-benzoxazol-2-yl)anilino]-5-oxo-pentanoic acid CAS Name: 5-[2-(5-chloro-1,3-benzoxazol-2-yl)anilino]-5-oxopentanoic acid IUPAC Name: 5-[2-(5-chloro-1,3-benzoxazol-2-yl)anilino]-5-oxopentanoic acid Traditional Name: 5-[2-(5-chloro-1,3-benzoxazol-2-yl)anilino]-5-keto-valeric acid Formula: C18H15ClN2O4 MolecularWeight: 358.7757

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C2=NC3=C(O2)C=CC(=C3)Cl)NC(=O)CCCC(=O)O

Isomeric SMILES

C1=CC=C(C(=C1)C2=NC3=C(O2)C=CC(=C3)Cl)NC(=O)CCCC(=O)O

InChI

InChI=1S/C18H15ClN2O4/c19-11-8-9-15-14(10-11)21-18(25-15)12-4-1-2-5-13(12)20-16(22)6-3-7-17(23)24/h1-2,4-5,8-10H,3,6-7H2,(H,20,22)(H,23,24)