(5-chloranyl-2,3-dihydro-1,4-benzodioxin-7-yl)methyl (E)-3-quinolin-2-ylprop-2-enoate

Systemtic Name: (5-chloranyl-2,3-dihydro-1,4-benzodioxin-7-yl)methyl (E)-3-quinolin-2-ylprop-2-enoate Openeye Name: (5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)methyl (E)-3-(2-quinolyl)prop-2-enoate CAS Name: (E)-3-(2-quinolinyl)-2-propenoic acid (5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)methyl ester IUPAC Name: (5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)methyl (E)-3-quinolin-2-ylprop-2-enoate Traditional Name: (E)-3-(2-quinolyl)acrylic acid (5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)methyl ester Formula: C21H16ClNO4 MolecularWeight: 381.80904

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=C(C=C2Cl)COC(=O)C=CC3=NC4=CC=CC=C4C=C3

Isomeric SMILES

C1COC2=C(O1)C=C(C=C2Cl)COC(=O)/C=C/C3=NC4=CC=CC=C4C=C3

InChI

InChI=1S/C21H16ClNO4/c22-17-11-14(12-19-21(17)26-10-9-25-19)13-27-20(24)8-7-16-6-5-15-3-1-2-4-18(15)23-16/h1-8,11-12H,9-10,13H2/b8-7+