(5-ethanoyl-2-methoxy-phenyl)methyl 3-(1-adamantylcarbamoylamino)propanoate

Systemtic Name: (5-ethanoyl-2-methoxy-phenyl)methyl 3-(1-adamantylcarbamoylamino)propanoate Openeye Name: (5-acetyl-2-methoxy-phenyl)methyl 3-(1-adamantylcarbamoylamino)propanoate CAS Name: 3-[[(1-adamantylamino)-oxomethyl]amino]propanoic acid (5-acetyl-2-methoxyphenyl)methyl ester IUPAC Name: (5-acetyl-2-methoxyphenyl)methyl 3-(1-adamantylcarbamoylamino)propanoate Traditional Name: 3-(1-adamantylcarbamoylamino)propionic acid (5-acetyl-2-methoxy-benzyl) ester Formula: C24H32N2O5 MolecularWeight: 428.52128

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=C(C=C1)OC)COC(=O)CCNC(=O)NC23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CC(=O)C1=CC(=C(C=C1)OC)COC(=O)CCNC(=O)NC23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C24H32N2O5/c1-15(27)19-3-4-21(30-2)20(10-19)14-31-22(28)5-6-25-23(29)26-24-11-16-7-17(12-24)9-18(8-16)13-24/h3-4,10,16-18H,5-9,11-14H2,1-2H3,(H2,25,26,29)