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

Systemtic Name: (E)-N-butyl-3-(6-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-2-cyano-prop-2-enamide Openeye Name: (E)-N-butyl-3-(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-2-cyano-prop-2-enamide CAS Name: (E)-N-butyl-3-(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-2-cyano-2-propenamide IUPAC Name: (E)-N-butyl-3-(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-2-cyanoprop-2-enamide Traditional Name: (E)-N-butyl-3-(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-2-cyano-acrylamide Formula: C17H19ClN2O3 MolecularWeight: 334.79736

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H19ClN2O3/c1-2-3-5-20-17(21)13(11-19)8-12-9-14(18)16-15(10-12)22-6-4-7-23-16/h8-10H,2-7H2,1H3,(H,20,21)/b13-8+