[1-(2,3-dihydro-1H-inden-5-yl)-1-oxidanylidene-propan-2-yl] 2-(1-adamantylcarbonylamino)ethanoate

Systemtic Name: [1-(2,3-dihydro-1H-inden-5-yl)-1-oxidanylidene-propan-2-yl] 2-(1-adamantylcarbonylamino)ethanoate Openeye Name: (2-indan-5-yl-1-methyl-2-oxo-ethyl) 2-(adamantane-1-carbonylamino)acetate CAS Name: 2-[[1-adamantyl(oxo)methyl]amino]acetic acid [1-(2,3-dihydro-1H-inden-5-yl)-1-oxopropan-2-yl] ester IUPAC Name: [1-(2,3-dihydro-1H-inden-5-yl)-1-oxopropan-2-yl] 2-(adamantane-1-carbonylamino)acetate Traditional Name: 2-(adamantane-1-carbonylamino)acetic acid (2-indan-5-yl-2-keto-1-methyl-ethyl) ester Formula: C25H31NO4 MolecularWeight: 409.51794

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C1=CC2=C(CCC2)C=C1)OC(=O)CNC(=O)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CC(C(=O)C1=CC2=C(CCC2)C=C1)OC(=O)CNC(=O)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C25H31NO4/c1-15(23(28)21-6-5-19-3-2-4-20(19)10-21)30-22(27)14-26-24(29)25-11-16-7-17(12-25)9-18(8-16)13-25/h5-6,10,15-18H,2-4,7-9,11-14H2,1H3,(H,26,29)