(E)-N-(7-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-3-quinolin-8-yl-prop-2-enamide

Systemtic Name: (E)-N-(7-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-3-quinolin-8-yl-prop-2-enamide Openeye Name: (E)-N-(7-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-3-(8-quinolyl)prop-2-enamide CAS Name: (E)-N-(7-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-3-(8-quinolinyl)-2-propenamide IUPAC Name: (E)-N-(7-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-3-quinolin-8-ylprop-2-enamide Traditional Name: (E)-N-(7-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-3-(8-quinolyl)acrylamide Formula: C21H17ClN2O3 MolecularWeight: 380.82428

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C=C(C(=C2)NC(=O)C=CC3=CC=CC4=C3N=CC=C4)Cl)OC1

Isomeric SMILES

C1COC2=C(C=C(C(=C2)NC(=O)/C=C/C3=CC=CC4=C3N=CC=C4)Cl)OC1

InChI

InChI=1S/C21H17ClN2O3/c22-16-12-18-19(27-11-3-10-26-18)13-17(16)24-20(25)8-7-15-5-1-4-14-6-2-9-23-21(14)15/h1-2,4-9,12-13H,3,10-11H2,(H,24,25)/b8-7+