5-methyl-2-propan-2-yl-cyclohexan-1-ol; 1-[(E)-(5-nitrofuran-2-yl)methylideneamino]urea

Systemtic Name: 5-methyl-2-propan-2-yl-cyclohexan-1-ol; 1-[(E)-(5-nitrofuran-2-yl)methylideneamino]urea Openeye Name: 2-isopropyl-5-methyl-cyclohexanol; [(E)-(5-nitro-2-furyl)methyleneamino]urea CAS Name: 5-methyl-2-propan-2-yl-1-cyclohexanol; [(E)-(5-nitro-2-furanyl)methylideneamino]urea IUPAC Name: 5-methyl-2-propan-2-ylcyclohexan-1-ol; [(E)-(5-nitrofuran-2-yl)methylideneamino]urea Traditional Name: 2-isopropyl-5-methyl-cyclohexanol; [(E)-(5-nitro-2-furyl)methyleneamino]urea Formula: C16H26N4O5 MolecularWeight: 354.40144

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(C(C1)O)C(C)C.C1=C(OC(=C1)[N+](=O)[O-])C=NNC(=O)N

Isomeric SMILES

CC1CCC(C(C1)O)C(C)C.C1=C(OC(=C1)[N+](=O)[O-])/C=N/NC(=O)N

InChI

InChI=1S/C10H20O.C6H6N4O4/c1-7(2)9-5-4-8(3)6-10(9)11;7-6(11)9-8-3-4-1-2-5(14-4)10(12)13/h7-11H,4-6H2,1-3H3;1-3H,(H3,7,9,11)/b;8-3+