N-[(E)-(3-chloranyl-5-ethoxy-4-propoxy-phenyl)methylideneamino]-2,3-dihydro-1,4-benzodioxine-3-carboxamide

Systemtic Name: N-[(E)-(3-chloranyl-5-ethoxy-4-propoxy-phenyl)methylideneamino]-2,3-dihydro-1,4-benzodioxine-3-carboxamide Openeye Name: N-[(E)-(3-chloro-5-ethoxy-4-propoxy-phenyl)methyleneamino]-2,3-dihydro-1,4-benzodioxine-3-carboxamide CAS Name: N-[(E)-(3-chloro-5-ethoxy-4-propoxyphenyl)methylideneamino]-2,3-dihydro-1,4-benzodioxin-3-carboxamide IUPAC Name: N-[(E)-(3-chloro-5-ethoxy-4-propoxyphenyl)methylideneamino]-2,3-dihydro-1,4-benzodioxine-3-carboxamide Traditional Name: N-[(E)-(3-chloro-5-ethoxy-4-propoxy-benzylidene)amino]-2,3-dihydro-1,4-benzodioxin-3-carboxamide Formula: C21H23ClN2O5 MolecularWeight: 418.87072

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1Cl)C=NNC(=O)C2COC3=CC=CC=C3O2)OCC

Isomeric SMILES

CCCOC1=C(C=C(C=C1Cl)/C=N/NC(=O)C2COC3=CC=CC=C3O2)OCC

InChI

InChI=1S/C21H23ClN2O5/c1-3-9-27-20-15(22)10-14(11-18(20)26-4-2)12-23-24-21(25)19-13-28-16-7-5-6-8-17(16)29-19/h5-8,10-12,19H,3-4,9,13H2,1-2H3,(H,24,25)/b23-12+