[4-[[3-(1-adamantylmethylcarbamoyl)-4-chloranyl-phenyl]methylamino]cyclohexyl]carbamic acid

Systemtic Name: [4-[[3-(1-adamantylmethylcarbamoyl)-4-chloranyl-phenyl]methylamino]cyclohexyl]carbamic acid Openeye Name: [4-[[3-(1-adamantylmethylcarbamoyl)-4-chloro-phenyl]methylamino]cyclohexyl]carbamic acid CAS Name: [4-[[3-[(1-adamantylmethylamino)-oxomethyl]-4-chlorophenyl]methylamino]cyclohexyl]carbamic acid IUPAC Name: [4-[[3-(1-adamantylmethylcarbamoyl)-4-chlorophenyl]methylamino]cyclohexyl]carbamic acid Traditional Name: [4-[[3-(1-adamantylmethylcarbamoyl)-4-chloro-benzyl]amino]cyclohexyl]carbamic acid Formula: C26H36ClN3O3 MolecularWeight: 474.03534

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1NCC2=CC(=C(C=C2)Cl)C(=O)NCC34CC5CC(C3)CC(C5)C4)NC(=O)O

Isomeric SMILES

C1CC(CCC1NCC2=CC(=C(C=C2)Cl)C(=O)NCC34CC5CC(C3)CC(C5)C4)NC(=O)O

InChI

InChI=1S/C26H36ClN3O3/c27-23-6-1-16(14-28-20-2-4-21(5-3-20)30-25(32)33)10-22(23)24(31)29-15-26-11-17-7-18(12-26)9-19(8-17)13-26/h1,6,10,17-21,28,30H,2-5,7-9,11-15H2,(H,29,31)(H,32,33)