[(1S)-2-oxidanylidenecyclohexyl] (E)-3-quinolin-2-ylprop-2-enoate

Systemtic Name: [(1S)-2-oxidanylidenecyclohexyl] (E)-3-quinolin-2-ylprop-2-enoate Openeye Name: [(1S)-2-oxocyclohexyl] (E)-3-(2-quinolyl)prop-2-enoate CAS Name: (E)-3-(2-quinolinyl)-2-propenoic acid [(1S)-2-oxocyclohexyl] ester IUPAC Name: [(1S)-2-oxocyclohexyl] (E)-3-quinolin-2-ylprop-2-enoate Traditional Name: (E)-3-(2-quinolyl)acrylic acid [(1S)-2-ketocyclohexyl] ester Formula: C18H17NO3 MolecularWeight: 295.33248

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=O)C(C1)OC(=O)C=CC2=NC3=CC=CC=C3C=C2

Isomeric SMILES

C1CCC(=O)[C@H](C1)OC(=O)/C=C/C2=NC3=CC=CC=C3C=C2

InChI

InChI=1S/C18H17NO3/c20-16-7-3-4-8-17(16)22-18(21)12-11-14-10-9-13-5-1-2-6-15(13)19-14/h1-2,5-6,9-12,17H,3-4,7-8H2/b12-11+/t17-/m0/s1