[(2R)-1-(1-adamantylamino)-1-oxidanylidene-propan-2-yl] 2-[(3-methoxyphenyl)carbonylamino]ethanoate

Systemtic Name: [(2R)-1-(1-adamantylamino)-1-oxidanylidene-propan-2-yl] 2-[(3-methoxyphenyl)carbonylamino]ethanoate Openeye Name: [(1R)-2-(1-adamantylamino)-1-methyl-2-oxo-ethyl] 2-[(3-methoxybenzoyl)amino]acetate CAS Name: 2-[[(3-methoxyphenyl)-oxomethyl]amino]acetic acid [(2R)-1-(1-adamantylamino)-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-(1-adamantylamino)-1-oxopropan-2-yl] 2-[(3-methoxybenzoyl)amino]acetate Traditional Name: 2-(m-anisoylamino)acetic acid [(1R)-2-(1-adamantylamino)-2-keto-1-methyl-ethyl] ester Formula: C23H30N2O5 MolecularWeight: 414.4947

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC12CC3CC(C1)CC(C3)C2)OC(=O)CNC(=O)C4=CC(=CC=C4)OC

Isomeric SMILES

C[C@H](C(=O)NC12CC3CC(C1)CC(C3)C2)OC(=O)CNC(=O)C4=CC(=CC=C4)OC

InChI

InChI=1S/C23H30N2O5/c1-14(21(27)25-23-10-15-6-16(11-23)8-17(7-15)12-23)30-20(26)13-24-22(28)18-4-3-5-19(9-18)29-2/h3-5,9,14-17H,6-8,10-13H2,1-2H3,(H,24,28)(H,25,27)/t14-,15?,16?,17?,23?/m1/s1