2-[[(3E)-3-(6H-benzo[c][1]benzoxepin-11-ylidene)propyl]-methyl-amino]ethanoate

Systemtic Name: 2-[[(3E)-3-(6H-benzo[c][1]benzoxepin-11-ylidene)propyl]-methyl-amino]ethanoate Openeye Name: 2-[[(3E)-3-(6H-benzo[c][1]benzoxepin-11-ylidene)propyl]-methyl-amino]acetate CAS Name: 2-[[(3E)-3-(6H-benzo[c][1]benzoxepin-11-ylidene)propyl]-methylamino]acetate IUPAC Name: 2-[[(3E)-3-(6H-benzo[c][1]benzoxepin-11-ylidene)propyl]-methylamino]acetate Traditional Name: 2-[[(3E)-3-(6H-benzo[c][1]benzoxepin-11-ylidene)propyl]-methyl-amino]acetate Formula: C20H20NO3- MolecularWeight: 322.3777

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC=C1C2=CC=CC=C2COC3=CC=CC=C31)CC(=O)[O-]

Isomeric SMILES

CN(CC/C=C/1\C2=CC=CC=C2COC3=CC=CC=C31)CC(=O)[O-]

InChI

InChI=1S/C20H21NO3/c1-21(13-20(22)23)12-6-10-17-16-8-3-2-7-15(16)14-24-19-11-5-4-9-18(17)19/h2-5,7-11H,6,12-14H2,1H3,(H,22,23)/p-1/b17-10+