(E)-3-(6-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-2-cyano-N-propan-2-yl-prop-2-enamide

Systemtic Name: (E)-3-(6-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-2-cyano-N-propan-2-yl-prop-2-enamide Openeye Name: (E)-3-(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-2-cyano-N-isopropyl-prop-2-enamide CAS Name: (E)-3-(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-2-cyano-N-propan-2-yl-2-propenamide IUPAC Name: (E)-3-(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-2-cyano-N-propan-2-ylprop-2-enamide Traditional Name: (E)-3-(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-2-cyano-N-isopropyl-acrylamide Formula: C16H17ClN2O3 MolecularWeight: 320.77078

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC(C)NC(=O)/C(=C/C1=CC2=C(C(=C1)Cl)OCCCO2)/C#N

InChI

InChI=1S/C16H17ClN2O3/c1-10(2)19-16(20)12(9-18)6-11-7-13(17)15-14(8-11)21-4-3-5-22-15/h6-8,10H,3-5H2,1-2H3,(H,19,20)/b12-6+