[(5S,7R)-3-(phenylmethoxycarbonylamino)-1-adamantyl] ethanoate

Systemtic Name: [(5S,7R)-3-(phenylmethoxycarbonylamino)-1-adamantyl] ethanoate Openeye Name: [(5S,7R)-3-(benzyloxycarbonylamino)-1-adamantyl] acetate CAS Name: acetic acid [(5S,7R)-3-(phenylmethoxycarbonylamino)-1-adamantyl] ester IUPAC Name: [(5S,7R)-3-(phenylmethoxycarbonylamino)-1-adamantyl] acetate Traditional Name: acetic acid [(5S,7R)-3-(benzyloxycarbonylamino)-1-adamantyl] ester Formula: C20H25NO4 MolecularWeight: 343.4168

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC12CC3CC(C1)CC(C3)(C2)NC(=O)OCC4=CC=CC=C4

Isomeric SMILES

CC(=O)OC12C[C@@H]3C[C@H](C1)CC(C3)(C2)NC(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C20H25NO4/c1-14(22)25-20-10-16-7-17(11-20)9-19(8-16,13-20)21-18(23)24-12-15-5-3-2-4-6-15/h2-6,16-17H,7-13H2,1H3,(H,21,23)/t16-,17+,19?,20?