[2-[[(1R)-1-(1-adamantyl)ethyl]amino]-2-oxidanylidene-ethyl] (E)-but-2-enoate

Systemtic Name: [2-[[(1R)-1-(1-adamantyl)ethyl]amino]-2-oxidanylidene-ethyl] (E)-but-2-enoate Openeye Name: [2-[[(1R)-1-(1-adamantyl)ethyl]amino]-2-oxo-ethyl] (E)-but-2-enoate CAS Name: (E)-2-butenoic acid [2-[[(1R)-1-(1-adamantyl)ethyl]amino]-2-oxoethyl] ester IUPAC Name: [2-[[(1R)-1-(1-adamantyl)ethyl]amino]-2-oxoethyl] (E)-but-2-enoate Traditional Name: (E)-but-2-enoic acid [2-[[(1R)-1-(1-adamantyl)ethyl]amino]-2-keto-ethyl] ester Formula: C18H27NO3 MolecularWeight: 305.41188

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Descriptors Computed from Structure

Canonical SMILES:

CC=CC(=O)OCC(=O)NC(C)C12CC3CC(C1)CC(C3)C2

Isomeric SMILES

C/C=C/C(=O)OCC(=O)N[C@H](C)C12CC3CC(C1)CC(C3)C2

InChI

InChI=1S/C18H27NO3/c1-3-4-17(21)22-11-16(20)19-12(2)18-8-13-5-14(9-18)7-15(6-13)10-18/h3-4,12-15H,5-11H2,1-2H3,(H,19,20)/b4-3+/t12-,13?,14?,15?,18?/m1/s1