methyl 4-methyl-3-[2-[2-[(5S,7R)-3-oxidanyl-1-adamantyl]ethanoyloxy]ethanoylamino]benzoate

Systemtic Name: methyl 4-methyl-3-[2-[2-[(5S,7R)-3-oxidanyl-1-adamantyl]ethanoyloxy]ethanoylamino]benzoate Openeye Name: methyl 3-[[2-[2-[(5S,7R)-3-hydroxy-1-adamantyl]acetyl]oxyacetyl]amino]-4-methyl-benzoate CAS Name: 3-[[2-[2-[(5S,7R)-3-hydroxy-1-adamantyl]-1-oxoethoxy]-1-oxoethyl]amino]-4-methylbenzoic acid methyl ester IUPAC Name: methyl 3-[[2-[2-[(5S,7R)-3-hydroxy-1-adamantyl]acetyl]oxyacetyl]amino]-4-methylbenzoate Traditional Name: 3-[[2-[2-[(5S,7R)-3-hydroxy-1-adamantyl]acetyl]oxyacetyl]amino]-4-methyl-benzoic acid methyl ester Formula: C23H29NO6 MolecularWeight: 415.47946

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)COC(=O)CC23CC4CC(C2)CC(C4)(C3)O

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)COC(=O)CC23C[C@H]4C[C@@H](C2)CC(C4)(C3)O

InChI

InChI=1S/C23H29NO6/c1-14-3-4-17(21(27)29-2)6-18(14)24-19(25)12-30-20(26)11-22-7-15-5-16(8-22)10-23(28,9-15)13-22/h3-4,6,15-16,28H,5,7-13H2,1-2H3,(H,24,25)/t15-,16+,22?,23?