(2-naphthalen-2-yl-2-oxidanylidene-ethyl) 3-(1-adamantylcarbamoylamino)propanoate

Systemtic Name: (2-naphthalen-2-yl-2-oxidanylidene-ethyl) 3-(1-adamantylcarbamoylamino)propanoate Openeye Name: [2-(2-naphthyl)-2-oxo-ethyl] 3-(1-adamantylcarbamoylamino)propanoate CAS Name: 3-[[(1-adamantylamino)-oxomethyl]amino]propanoic acid [2-(2-naphthalenyl)-2-oxoethyl] ester IUPAC Name: (2-naphthalen-2-yl-2-oxoethyl) 3-(1-adamantylcarbamoylamino)propanoate Traditional Name: 3-(1-adamantylcarbamoylamino)propionic acid [2-keto-2-(2-naphthyl)ethyl] ester Formula: C26H30N2O4 MolecularWeight: 434.5274

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)NC(=O)NCCC(=O)OCC(=O)C4=CC5=CC=CC=C5C=C4

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)NC(=O)NCCC(=O)OCC(=O)C4=CC5=CC=CC=C5C=C4

InChI

InChI=1S/C26H30N2O4/c29-23(22-6-5-20-3-1-2-4-21(20)12-22)16-32-24(30)7-8-27-25(31)28-26-13-17-9-18(14-26)11-19(10-17)15-26/h1-6,12,17-19H,7-11,13-16H2,(H2,27,28,31)