[(2R)-1-(1H-indol-3-yl)-1-oxidanylidene-propan-2-yl] 2-[2-(1-adamantyl)ethanoylamino]ethanoate

Systemtic Name: [(2R)-1-(1H-indol-3-yl)-1-oxidanylidene-propan-2-yl] 2-[2-(1-adamantyl)ethanoylamino]ethanoate Openeye Name: [(1R)-2-(1H-indol-3-yl)-1-methyl-2-oxo-ethyl] 2-[[2-(1-adamantyl)acetyl]amino]acetate CAS Name: 2-[[2-(1-adamantyl)-1-oxoethyl]amino]acetic acid [(2R)-1-(1H-indol-3-yl)-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-(1H-indol-3-yl)-1-oxopropan-2-yl] 2-[[2-(1-adamantyl)acetyl]amino]acetate Traditional Name: 2-[[2-(1-adamantyl)acetyl]amino]acetic acid [(1R)-2-(1H-indol-3-yl)-2-keto-1-methyl-ethyl] ester Formula: C25H30N2O4 MolecularWeight: 422.5167

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C1=CNC2=CC=CC=C21)OC(=O)CNC(=O)CC34CC5CC(C3)CC(C5)C4

Isomeric SMILES

C[C@H](C(=O)C1=CNC2=CC=CC=C21)OC(=O)CNC(=O)CC34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C25H30N2O4/c1-15(24(30)20-13-26-21-5-3-2-4-19(20)21)31-23(29)14-27-22(28)12-25-9-16-6-17(10-25)8-18(7-16)11-25/h2-5,13,15-18,26H,6-12,14H2,1H3,(H,27,28)/t15-,16?,17?,18?,25?/m1/s1