N-[4-(2-methylbutan-2-yl)cyclohexyl]-4-(6-nitro-2-oxidanylidene-1,3-benzoxazol-3-yl)butanamide

Systemtic Name: N-[4-(2-methylbutan-2-yl)cyclohexyl]-4-(6-nitro-2-oxidanylidene-1,3-benzoxazol-3-yl)butanamide Openeye Name: N-[4-(1,1-dimethylpropyl)cyclohexyl]-4-(6-nitro-2-oxo-1,3-benzoxazol-3-yl)butanamide CAS Name: N-[4-(2-methylbutan-2-yl)cyclohexyl]-4-(6-nitro-2-oxo-1,3-benzoxazol-3-yl)butanamide IUPAC Name: N-[4-(2-methylbutan-2-yl)cyclohexyl]-4-(6-nitro-2-oxo-1,3-benzoxazol-3-yl)butanamide Traditional Name: N-(4-tert-amylcyclohexyl)-4-(2-keto-6-nitro-1,3-benzoxazol-3-yl)butyramide Formula: C22H31N3O5 MolecularWeight: 417.49864

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C1CCC(CC1)NC(=O)CCCN2C3=C(C=C(C=C3)[N+](=O)[O-])OC2=O

Isomeric SMILES

CCC(C)(C)C1CCC(CC1)NC(=O)CCCN2C3=C(C=C(C=C3)[N+](=O)[O-])OC2=O

InChI

InChI=1S/C22H31N3O5/c1-4-22(2,3)15-7-9-16(10-8-15)23-20(26)6-5-13-24-18-12-11-17(25(28)29)14-19(18)30-21(24)27/h11-12,14-16H,4-10,13H2,1-3H3,(H,23,26)