[(1R)-1-cyanoethyl] (E)-3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)prop-2-enoate

Systemtic Name: [(1R)-1-cyanoethyl] (E)-3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)prop-2-enoate Openeye Name: [(1R)-1-cyanoethyl] (E)-3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)prop-2-enoate CAS Name: (E)-3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-propenoic acid [(1R)-1-cyanoethyl] ester IUPAC Name: [(1R)-1-cyanoethyl] (E)-3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)prop-2-enoate Traditional Name: (E)-3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)acrylic acid [(1R)-1-cyanoethyl] ester Formula: C15H15NO4 MolecularWeight: 273.2839

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Descriptors Computed from Structure

Canonical SMILES:

CC(C#N)OC(=O)C=CC1=CC2=C(C=C1)OCCCO2

Isomeric SMILES

C[C@H](C#N)OC(=O)/C=C/C1=CC2=C(C=C1)OCCCO2

InChI

InChI=1S/C15H15NO4/c1-11(10-16)20-15(17)6-4-12-3-5-13-14(9-12)19-8-2-7-18-13/h3-6,9,11H,2,7-8H2,1H3/b6-4+/t11-/m1/s1