[(2R)-1-(1-adamantyl)-1-oxidanylidene-propan-2-yl] (2R)-2-(2-phenoxyethanoylamino)propanoate

Systemtic Name: [(2R)-1-(1-adamantyl)-1-oxidanylidene-propan-2-yl] (2R)-2-(2-phenoxyethanoylamino)propanoate Openeye Name: [(1R)-2-(1-adamantyl)-1-methyl-2-oxo-ethyl] (2R)-2-[(2-phenoxyacetyl)amino]propanoate CAS Name: (2R)-2-[(1-oxo-2-phenoxyethyl)amino]propanoic acid [(2R)-1-(1-adamantyl)-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-(1-adamantyl)-1-oxopropan-2-yl] (2R)-2-[(2-phenoxyacetyl)amino]propanoate Traditional Name: (2R)-2-[(2-phenoxyacetyl)amino]propionic acid [(1R)-2-(1-adamantyl)-2-keto-1-methyl-ethyl] ester Formula: C24H31NO5 MolecularWeight: 413.50664

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OC(C)C(=O)C12CC3CC(C1)CC(C3)C2)NC(=O)COC4=CC=CC=C4

Isomeric SMILES

C[C@H](C(=O)O[C@H](C)C(=O)C12CC3CC(C1)CC(C3)C2)NC(=O)COC4=CC=CC=C4

InChI

InChI=1S/C24H31NO5/c1-15(25-21(26)14-29-20-6-4-3-5-7-20)23(28)30-16(2)22(27)24-11-17-8-18(12-24)10-19(9-17)13-24/h3-7,15-19H,8-14H2,1-2H3,(H,25,26)/t15-,16-,17?,18?,19?,24?/m1/s1