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

Systemtic Name: [(2R)-5,5-diethoxypent-3-yn-2-yl] (E)-3-(3-nitrocyclohexyl)prop-2-enoate Openeye Name: [(1R)-4,4-diethoxy-1-methyl-but-2-ynyl] (E)-3-(3-nitrocyclohexyl)prop-2-enoate CAS Name: (E)-3-(3-nitrocyclohexyl)-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-nitrocyclohexyl)prop-2-enoate Traditional Name: (E)-3-(3-nitrocyclohexyl)acrylic acid [(1R)-4,4-diethoxy-1-methyl-but-2-ynyl] ester Formula: C18H27NO6 MolecularWeight: 353.41008

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(C#CC(C)OC(=O)C=CC1CCCC(C1)[N+](=O)[O-])OCC

Isomeric SMILES

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

InChI

InChI=1S/C18H27NO6/c1-4-23-18(24-5-2)12-9-14(3)25-17(20)11-10-15-7-6-8-16(13-15)19(21)22/h10-11,14-16,18H,4-8,13H2,1-3H3/b11-10+/t14-,15?,16?/m1/s1