[2-[2-(furan-2-ylcarbonyl)hydrazinyl]-2-oxidanylidene-ethyl] (2S)-2-(1-adamantylcarbonylamino)propanoate

Systemtic Name: [2-[2-(furan-2-ylcarbonyl)hydrazinyl]-2-oxidanylidene-ethyl] (2S)-2-(1-adamantylcarbonylamino)propanoate Openeye Name: [2-[2-(furan-2-carbonyl)hydrazino]-2-oxo-ethyl] (2S)-2-(adamantane-1-carbonylamino)propanoate CAS Name: (2S)-2-[[1-adamantyl(oxo)methyl]amino]propanoic acid [2-[[2-furanyl(oxo)methyl]hydrazo]-2-oxoethyl] ester IUPAC Name: [2-[2-(furan-2-carbonyl)hydrazinyl]-2-oxoethyl] (2S)-2-(adamantane-1-carbonylamino)propanoate Traditional Name: (2S)-2-(adamantane-1-carbonylamino)propionic acid [2-[N'-(2-furoyl)hydrazino]-2-keto-ethyl] ester Formula: C21H27N3O6 MolecularWeight: 417.45558

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OCC(=O)NNC(=O)C1=CC=CO1)NC(=O)C23CC4CC(C2)CC(C4)C3

Isomeric SMILES

C[C@@H](C(=O)OCC(=O)NNC(=O)C1=CC=CO1)NC(=O)C23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C21H27N3O6/c1-12(19(27)30-11-17(25)23-24-18(26)16-3-2-4-29-16)22-20(28)21-8-13-5-14(9-21)7-15(6-13)10-21/h2-4,12-15H,5-11H2,1H3,(H,22,28)(H,23,25)(H,24,26)/t12-,13?,14?,15?,21?/m0/s1