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

Systemtic Name: (E)-3-(6-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-N-(4-ethoxy-3-methoxy-phenyl)prop-2-enamide Openeye Name: (E)-3-(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-N-(4-ethoxy-3-methoxy-phenyl)prop-2-enamide CAS Name: (E)-3-(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-N-(4-ethoxy-3-methoxyphenyl)-2-propenamide IUPAC Name: (E)-3-(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-N-(4-ethoxy-3-methoxyphenyl)prop-2-enamide Traditional Name: (E)-3-(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-N-(4-ethoxy-3-methoxy-phenyl)acrylamide Formula: C21H22ClNO5 MolecularWeight: 403.85608

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)NC(=O)C=CC2=CC3=C(C(=C2)Cl)OCCCO3)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1)NC(=O)/C=C/C2=CC3=C(C(=C2)Cl)OCCCO3)OC

InChI

InChI=1S/C21H22ClNO5/c1-3-26-17-7-6-15(13-18(17)25-2)23-20(24)8-5-14-11-16(22)21-19(12-14)27-9-4-10-28-21/h5-8,11-13H,3-4,9-10H2,1-2H3,(H,23,24)/b8-5+