[(2R)-5,5-diethoxypent-3-yn-2-yl] (E)-3-[3-(ethoxycarbonylamino)cyclohexyl]prop-2-enoate

Systemtic Name: [(2R)-5,5-diethoxypent-3-yn-2-yl] (E)-3-[3-(ethoxycarbonylamino)cyclohexyl]prop-2-enoate Openeye Name: [(1R)-4,4-diethoxy-1-methyl-but-2-ynyl] (E)-3-[3-(ethoxycarbonylamino)cyclohexyl]prop-2-enoate CAS Name: (E)-3-[3-(ethoxycarbonylamino)cyclohexyl]-2-propenoic acid [(2R)-5,5-diethoxypent-3-yn-2-yl] ester IUPAC Name: [(2R)-5,5-diethoxypent-3-yn-2-yl] (E)-3-[3-(ethoxycarbonylamino)cyclohexyl]prop-2-enoate Traditional Name: (E)-3-[3-(carbethoxyamino)cyclohexyl]acrylic acid [(1R)-4,4-diethoxy-1-methyl-but-2-ynyl] ester Formula: C21H33NO6 MolecularWeight: 395.48982

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(C#CC(C)OC(=O)C=CC1CCCC(C1)NC(=O)OCC)OCC

Isomeric SMILES

CCOC(C#C[C@@H](C)OC(=O)/C=C/C1CCCC(C1)NC(=O)OCC)OCC

InChI

InChI=1S/C21H33NO6/c1-5-25-20(26-6-2)14-11-16(4)28-19(23)13-12-17-9-8-10-18(15-17)22-21(24)27-7-3/h12-13,16-18,20H,5-10,15H2,1-4H3,(H,22,24)/b13-12+/t16-,17?,18?/m1/s1