methyl (2S)-2-(1-adamantyl)-2-(3-cyclohexylpropanoylamino)ethanoate

Systemtic Name: methyl (2S)-2-(1-adamantyl)-2-(3-cyclohexylpropanoylamino)ethanoate Openeye Name: methyl (2S)-2-(1-adamantyl)-2-(3-cyclohexylpropanoylamino)acetate CAS Name: (2S)-2-(1-adamantyl)-2-[(3-cyclohexyl-1-oxopropyl)amino]acetic acid methyl ester IUPAC Name: methyl (2S)-2-(1-adamantyl)-2-(3-cyclohexylpropanoylamino)acetate Traditional Name: (2S)-2-(1-adamantyl)-2-(3-cyclohexylpropanoylamino)acetic acid methyl ester Formula: C22H35NO3 MolecularWeight: 361.5182

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(C12CC3CC(C1)CC(C3)C2)NC(=O)CCC4CCCCC4

Isomeric SMILES

COC(=O)[C@H](C12CC3CC(C1)CC(C3)C2)NC(=O)CCC4CCCCC4

InChI

InChI=1S/C22H35NO3/c1-26-21(25)20(23-19(24)8-7-15-5-3-2-4-6-15)22-12-16-9-17(13-22)11-18(10-16)14-22/h15-18,20H,2-14H2,1H3,(H,23,24)/t16?,17?,18?,20-,22?/m1/s1