N-[(1-morpholin-4-ylcyclohexyl)methyl]-4-(6-nitro-2-oxidanylidene-1,3-benzoxazol-3-yl)butanamide

Systemtic Name: N-[(1-morpholin-4-ylcyclohexyl)methyl]-4-(6-nitro-2-oxidanylidene-1,3-benzoxazol-3-yl)butanamide Openeye Name: N-[(1-morpholinocyclohexyl)methyl]-4-(6-nitro-2-oxo-1,3-benzoxazol-3-yl)butanamide CAS Name: N-[[1-(4-morpholinyl)cyclohexyl]methyl]-4-(6-nitro-2-oxo-1,3-benzoxazol-3-yl)butanamide IUPAC Name: N-[(1-morpholin-4-ylcyclohexyl)methyl]-4-(6-nitro-2-oxo-1,3-benzoxazol-3-yl)butanamide Traditional Name: 4-(2-keto-6-nitro-1,3-benzoxazol-3-yl)-N-[(1-morpholinocyclohexyl)methyl]butyramide Formula: C22H30N4O6 MolecularWeight: 446.4968

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)(CNC(=O)CCCN2C3=C(C=C(C=C3)[N+](=O)[O-])OC2=O)N4CCOCC4

Isomeric SMILES

C1CCC(CC1)(CNC(=O)CCCN2C3=C(C=C(C=C3)[N+](=O)[O-])OC2=O)N4CCOCC4

InChI

InChI=1S/C22H30N4O6/c27-20(23-16-22(8-2-1-3-9-22)24-11-13-31-14-12-24)5-4-10-25-18-7-6-17(26(29)30)15-19(18)32-21(25)28/h6-7,15H,1-5,8-14,16H2,(H,23,27)