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

Systemtic Name: (E)-3-(6-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-2-cyano-N-(3-ethoxypropyl)prop-2-enamide Openeye Name: (E)-3-(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-2-cyano-N-(3-ethoxypropyl)prop-2-enamide CAS Name: (E)-3-(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-2-cyano-N-(3-ethoxypropyl)-2-propenamide IUPAC Name: (E)-3-(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-2-cyano-N-(3-ethoxypropyl)prop-2-enamide Traditional Name: (E)-3-(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-2-cyano-N-(3-ethoxypropyl)acrylamide Formula: C18H21ClN2O4 MolecularWeight: 364.82334

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H21ClN2O4/c1-2-23-6-3-5-21-18(22)14(12-20)9-13-10-15(19)17-16(11-13)24-7-4-8-25-17/h9-11H,2-8H2,1H3,(H,21,22)/b14-9+