[2-(1-adamantylmethylamino)-2-oxidanylidene-ethyl] (2S)-2-(2-phenoxyethanoylamino)propanoate

Systemtic Name: [2-(1-adamantylmethylamino)-2-oxidanylidene-ethyl] (2S)-2-(2-phenoxyethanoylamino)propanoate Openeye Name: [2-(1-adamantylmethylamino)-2-oxo-ethyl] (2S)-2-[(2-phenoxyacetyl)amino]propanoate CAS Name: (2S)-2-[(1-oxo-2-phenoxyethyl)amino]propanoic acid [2-(1-adamantylmethylamino)-2-oxoethyl] ester IUPAC Name: [2-(1-adamantylmethylamino)-2-oxoethyl] (2S)-2-[(2-phenoxyacetyl)amino]propanoate Traditional Name: (2S)-2-[(2-phenoxyacetyl)amino]propionic acid [2-(1-adamantylmethylamino)-2-keto-ethyl] ester Formula: C24H32N2O5 MolecularWeight: 428.52128

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OCC(=O)NCC12CC3CC(C1)CC(C3)C2)NC(=O)COC4=CC=CC=C4

Isomeric SMILES

C[C@@H](C(=O)OCC(=O)NCC12CC3CC(C1)CC(C3)C2)NC(=O)COC4=CC=CC=C4

InChI

InChI=1S/C24H32N2O5/c1-16(26-22(28)14-30-20-5-3-2-4-6-20)23(29)31-13-21(27)25-15-24-10-17-7-18(11-24)9-19(8-17)12-24/h2-6,16-19H,7-15H2,1H3,(H,25,27)(H,26,28)/t16-,17?,18?,19?,24?/m0/s1