2-[[3-(1-adamantyl)-7-chloranyl-1,2-benzoxazol-6-yl]oxy]ethanoic acid

Systemtic Name: 2-[[3-(1-adamantyl)-7-chloranyl-1,2-benzoxazol-6-yl]oxy]ethanoic acid Openeye Name: 2-[[3-(1-adamantyl)-7-chloro-1,2-benzoxazol-6-yl]oxy]acetic acid CAS Name: 2-[[3-(1-adamantyl)-7-chloro-1,2-benzoxazol-6-yl]oxy]acetic acid IUPAC Name: 2-[[3-(1-adamantyl)-7-chloro-1,2-benzoxazol-6-yl]oxy]acetic acid Traditional Name: 2-[3-(1-adamantyl)-7-chloro-indoxazen-6-yl]oxyacetic acid Formula: C19H20ClNO4 MolecularWeight: 361.8194

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C4=NOC5=C4C=CC(=C5Cl)OCC(=O)O

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C4=NOC5=C4C=CC(=C5Cl)OCC(=O)O

InChI

InChI=1S/C19H20ClNO4/c20-16-14(24-9-15(22)23)2-1-13-17(16)25-21-18(13)19-6-10-3-11(7-19)5-12(4-10)8-19/h1-2,10-12H,3-9H2,(H,22,23)