methyl 3-[2-(1-adamantyl)ethanoylamino]-4-morpholin-4-yl-benzoate

Systemtic Name: methyl 3-[2-(1-adamantyl)ethanoylamino]-4-morpholin-4-yl-benzoate Openeye Name: methyl 3-[[2-(1-adamantyl)acetyl]amino]-4-morpholino-benzoate CAS Name: 3-[[2-(1-adamantyl)-1-oxoethyl]amino]-4-(4-morpholinyl)benzoic acid methyl ester IUPAC Name: methyl 3-[[2-(1-adamantyl)acetyl]amino]-4-morpholin-4-ylbenzoate Traditional Name: 3-[[2-(1-adamantyl)acetyl]amino]-4-morpholino-benzoic acid methyl ester Formula: C24H32N2O4 MolecularWeight: 412.52188

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(C=C1)N2CCOCC2)NC(=O)CC34CC5CC(C3)CC(C5)C4

Isomeric SMILES

COC(=O)C1=CC(=C(C=C1)N2CCOCC2)NC(=O)CC34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C24H32N2O4/c1-29-23(28)19-2-3-21(26-4-6-30-7-5-26)20(11-19)25-22(27)15-24-12-16-8-17(13-24)10-18(9-16)14-24/h2-3,11,16-18H,4-10,12-15H2,1H3,(H,25,27)