[2-[[(1R)-1-(1-adamantyl)ethyl]amino]-2-oxidanylidene-ethyl] (2R)-2-phenoxybutanoate

Systemtic Name: [2-[[(1R)-1-(1-adamantyl)ethyl]amino]-2-oxidanylidene-ethyl] (2R)-2-phenoxybutanoate Openeye Name: [2-[[(1R)-1-(1-adamantyl)ethyl]amino]-2-oxo-ethyl] (2R)-2-phenoxybutanoate CAS Name: (2R)-2-phenoxybutanoic acid [2-[[(1R)-1-(1-adamantyl)ethyl]amino]-2-oxoethyl] ester IUPAC Name: [2-[[(1R)-1-(1-adamantyl)ethyl]amino]-2-oxoethyl] (2R)-2-phenoxybutanoate Traditional Name: (2R)-2-phenoxybutyric acid [2-[[(1R)-1-(1-adamantyl)ethyl]amino]-2-keto-ethyl] ester Formula: C24H33NO4 MolecularWeight: 399.52312

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)OCC(=O)NC(C)C12CC3CC(C1)CC(C3)C2)OC4=CC=CC=C4

Isomeric SMILES

CC[C@H](C(=O)OCC(=O)N[C@H](C)C12CC3CC(C1)CC(C3)C2)OC4=CC=CC=C4

InChI

InChI=1S/C24H33NO4/c1-3-21(29-20-7-5-4-6-8-20)23(27)28-15-22(26)25-16(2)24-12-17-9-18(13-24)11-19(10-17)14-24/h4-8,16-19,21H,3,9-15H2,1-2H3,(H,25,26)/t16-,17?,18?,19?,21-,24?/m1/s1