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

Systemtic Name: (E)-N-butyl-3-(6-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-N-phenyl-prop-2-enamide Openeye Name: (E)-N-butyl-3-(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-N-phenyl-prop-2-enamide CAS Name: (E)-N-butyl-3-(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-N-phenyl-2-propenamide IUPAC Name: (E)-N-butyl-3-(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-N-phenylprop-2-enamide Traditional Name: (E)-N-butyl-3-(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-N-phenyl-acrylamide Formula: C22H24ClNO3 MolecularWeight: 385.88386

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C1=CC=CC=C1)C(=O)C=CC2=CC3=C(C(=C2)Cl)OCCCO3

Isomeric SMILES

CCCCN(C1=CC=CC=C1)C(=O)/C=C/C2=CC3=C(C(=C2)Cl)OCCCO3

InChI

InChI=1S/C22H24ClNO3/c1-2-3-12-24(18-8-5-4-6-9-18)21(25)11-10-17-15-19(23)22-20(16-17)26-13-7-14-27-22/h4-6,8-11,15-16H,2-3,7,12-14H2,1H3/b11-10+