[(2R)-1-(1-adamantylcarbamoylamino)-1-oxidanylidene-propan-2-yl] (E)-pent-2-enoate

Systemtic Name: [(2R)-1-(1-adamantylcarbamoylamino)-1-oxidanylidene-propan-2-yl] (E)-pent-2-enoate Openeye Name: [(1R)-2-(1-adamantylcarbamoylamino)-1-methyl-2-oxo-ethyl] (E)-pent-2-enoate CAS Name: (E)-2-pentenoic acid [(2R)-1-[[(1-adamantylamino)-oxomethyl]amino]-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-(1-adamantylcarbamoylamino)-1-oxopropan-2-yl] (E)-pent-2-enoate Traditional Name: (E)-pent-2-enoic acid [(1R)-2-(1-adamantylcarbamoylamino)-2-keto-1-methyl-ethyl] ester Formula: C19H28N2O4 MolecularWeight: 348.43662

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Descriptors Computed from Structure

Canonical SMILES:

CCC=CC(=O)OC(C)C(=O)NC(=O)NC12CC3CC(C1)CC(C3)C2

Isomeric SMILES

CC/C=C/C(=O)O[C@H](C)C(=O)NC(=O)NC12CC3CC(C1)CC(C3)C2

InChI

InChI=1S/C19H28N2O4/c1-3-4-5-16(22)25-12(2)17(23)20-18(24)21-19-9-13-6-14(10-19)8-15(7-13)11-19/h4-5,12-15H,3,6-11H2,1-2H3,(H2,20,21,23,24)/b5-4+/t12-,13?,14?,15?,19?/m1/s1