5-oxabicyclo[2.1.1]hexane; (phenylmethyl) N-[2-[methoxy(phenyl)methyl]-1,3-benzoxazol-7-yl]carbamate

Systemtic Name: 5-oxabicyclo[2.1.1]hexane; (phenylmethyl) N-[2-[methoxy(phenyl)methyl]-1,3-benzoxazol-7-yl]carbamate Openeye Name: benzyl N-[2-[methoxy(phenyl)methyl]-1,3-benzoxazol-7-yl]carbamate; 5-oxabicyclo[2.1.1]hexane CAS Name: N-[2-[methoxy(phenyl)methyl]-1,3-benzoxazol-7-yl]carbamic acid (phenylmethyl) ester; 5-oxabicyclo[2.1.1]hexane IUPAC Name: benzyl N-[2-[methoxy(phenyl)methyl]-1,3-benzoxazol-7-yl]carbamate; 5-oxabicyclo[2.1.1]hexane Traditional Name: N-[2-[methoxy(phenyl)methyl]-1,3-benzoxazol-7-yl]carbamic acid benzyl ester; 5-oxabicyclo[2.1.1]hexane Formula: C28H28N2O5 MolecularWeight: 472.53232

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Descriptors Computed from Structure

Canonical SMILES:

COC(C1=CC=CC=C1)C2=NC3=C(O2)C(=CC=C3)NC(=O)OCC4=CC=CC=C4.C1CC2CC1O2

Isomeric SMILES

COC(C1=CC=CC=C1)C2=NC3=C(O2)C(=CC=C3)NC(=O)OCC4=CC=CC=C4.C1CC2CC1O2

InChI

InChI=1S/C23H20N2O4.C5H8O/c1-27-20(17-11-6-3-7-12-17)22-24-18-13-8-14-19(21(18)29-22)25-23(26)28-15-16-9-4-2-5-10-16;1-2-5-3-4(1)6-5/h2-14,20H,15H2,1H3,(H,25,26);4-5H,1-3H2