(E)-4-[[2-chloranyl-11-(dimethylamino)-11,12-dihydro-10H-benzo[b][1]benzoxocin-3-yl]oxy]-4-oxidanylidene-but-2-enoate

Systemtic Name: (E)-4-[[2-chloranyl-11-(dimethylamino)-11,12-dihydro-10H-benzo[b][1]benzoxocin-3-yl]oxy]-4-oxidanylidene-but-2-enoate Openeye Name: (E)-4-[[2-chloro-11-(dimethylamino)-11,12-dihydro-10H-benzo[b][1]benzoxocin-3-yl]oxy]-4-oxo-but-2-enoate CAS Name: (E)-4-[[2-chloro-11-(dimethylamino)-11,12-dihydro-10H-benzo[b][1]benzoxocin-3-yl]oxy]-4-oxo-2-butenoate IUPAC Name: (E)-4-[[2-chloro-11-(dimethylamino)-11,12-dihydro-10H-benzo[b][1]benzoxocin-3-yl]oxy]-4-oxobut-2-enoate Traditional Name: (E)-4-[[2-chloro-11-(dimethylamino)-11,12-dihydro-10H-benzo[b][1]benzoxocin-3-yl]oxy]-4-keto-but-2-enoate Formula: C21H19ClNO5- MolecularWeight: 400.83226

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1CC2=CC=CC=C2OC3=CC(=C(C=C3C1)Cl)OC(=O)C=CC(=O)[O-]

Isomeric SMILES

CN(C)C1CC2=CC=CC=C2OC3=CC(=C(C=C3C1)Cl)OC(=O)/C=C/C(=O)[O-]

InChI

InChI=1S/C21H20ClNO5/c1-23(2)15-9-13-5-3-4-6-17(13)27-18-12-19(16(22)11-14(18)10-15)28-21(26)8-7-20(24)25/h3-8,11-12,15H,9-10H2,1-2H3,(H,24,25)/p-1/b8-7+