5-tert-butyl-3-[1-(5-nitrofuran-2-yl)carbonylpiperidin-4-yl]-1,3-benzoxazol-2-one

Systemtic Name: 5-tert-butyl-3-[1-(5-nitrofuran-2-yl)carbonylpiperidin-4-yl]-1,3-benzoxazol-2-one Openeye Name: 5-tert-butyl-3-[1-(5-nitrofuran-2-carbonyl)-4-piperidyl]-1,3-benzoxazol-2-one CAS Name: 5-tert-butyl-3-[1-[(5-nitro-2-furanyl)-oxomethyl]-4-piperidinyl]-1,3-benzoxazol-2-one IUPAC Name: 5-tert-butyl-3-[1-(5-nitrofuran-2-carbonyl)piperidin-4-yl]-1,3-benzoxazol-2-one Traditional Name: 5-tert-butyl-3-[1-(5-nitro-2-furoyl)-4-piperidyl]-1,3-benzoxazol-2-one Formula: C21H23N3O6 MolecularWeight: 413.42382

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC2=C(C=C1)OC(=O)N2C3CCN(CC3)C(=O)C4=CC=C(O4)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)C1=CC2=C(C=C1)OC(=O)N2C3CCN(CC3)C(=O)C4=CC=C(O4)[N+](=O)[O-]

InChI

InChI=1S/C21H23N3O6/c1-21(2,3)13-4-5-16-15(12-13)23(20(26)30-16)14-8-10-22(11-9-14)19(25)17-6-7-18(29-17)24(27)28/h4-7,12,14H,8-11H2,1-3H3