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

Systemtic Name: 6-[[(3E)-3-(6H-benzo[c][1]benzoxepin-11-ylidene)propyl]-methyl-amino]hexanoate Openeye Name: 6-[[(3E)-3-(6H-benzo[c][1]benzoxepin-11-ylidene)propyl]-methyl-amino]hexanoate CAS Name: 6-[[(3E)-3-(6H-benzo[c][1]benzoxepin-11-ylidene)propyl]-methylamino]hexanoate IUPAC Name: 6-[[(3E)-3-(6H-benzo[c][1]benzoxepin-11-ylidene)propyl]-methylamino]hexanoate Traditional Name: 6-[[(3E)-3-(6H-benzo[c][1]benzoxepin-11-ylidene)propyl]-methyl-amino]hexanoate Formula: C24H28NO3- MolecularWeight: 378.48402

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H29NO3/c1-25(16-8-2-3-15-24(26)27)17-9-13-21-20-11-5-4-10-19(20)18-28-23-14-7-6-12-22(21)23/h4-7,10-14H,2-3,8-9,15-18H2,1H3,(H,26,27)/p-1/b21-13+