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

Systemtic Name: [(2R)-1-(1-adamantylamino)-1-oxidanylidene-propan-2-yl] (E)-pent-2-enoate Openeye Name: [(1R)-2-(1-adamantylamino)-1-methyl-2-oxo-ethyl] (E)-pent-2-enoate CAS Name: (E)-2-pentenoic acid [(2R)-1-(1-adamantylamino)-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-(1-adamantylamino)-1-oxopropan-2-yl] (E)-pent-2-enoate Traditional Name: (E)-pent-2-enoic acid [(1R)-2-(1-adamantylamino)-2-keto-1-methyl-ethyl] ester Formula: C18H27NO3 MolecularWeight: 305.41188

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H27NO3/c1-3-4-5-16(20)22-12(2)17(21)19-18-9-13-6-14(10-18)8-15(7-13)11-18/h4-5,12-15H,3,6-11H2,1-2H3,(H,19,21)/b5-4+/t12-,13?,14?,15?,18?/m1/s1