3-[[3-(1-adamantylmethylcarbamoyl)-4-chloranyl-phenyl]methoxy]propyl-methyl-carbamic acid

Systemtic Name: 3-[[3-(1-adamantylmethylcarbamoyl)-4-chloranyl-phenyl]methoxy]propyl-methyl-carbamic acid Openeye Name: 3-[[3-(1-adamantylmethylcarbamoyl)-4-chloro-phenyl]methoxy]propyl-methyl-carbamic acid CAS Name: 3-[[3-[(1-adamantylmethylamino)-oxomethyl]-4-chlorophenyl]methoxy]propyl-methylcarbamic acid IUPAC Name: 3-[[3-(1-adamantylmethylcarbamoyl)-4-chlorophenyl]methoxy]propyl-methylcarbamic acid Traditional Name: 3-[3-(1-adamantylmethylcarbamoyl)-4-chloro-benzyl]oxypropyl-methyl-carbamic acid Formula: C24H33ClN2O4 MolecularWeight: 448.98282

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCOCC1=CC(=C(C=C1)Cl)C(=O)NCC23CC4CC(C2)CC(C4)C3)C(=O)O

Isomeric SMILES

CN(CCCOCC1=CC(=C(C=C1)Cl)C(=O)NCC23CC4CC(C2)CC(C4)C3)C(=O)O

InChI

InChI=1S/C24H33ClN2O4/c1-27(23(29)30)5-2-6-31-14-16-3-4-21(25)20(10-16)22(28)26-15-24-11-17-7-18(12-24)9-19(8-17)13-24/h3-4,10,17-19H,2,5-9,11-15H2,1H3,(H,26,28)(H,29,30)