4-[[(3E)-3-(6H-benzo[c][1]benzoxepin-11-ylidene)propyl]-methyl-amino]butanoate

Systemtic Name: 4-[[(3E)-3-(6H-benzo[c][1]benzoxepin-11-ylidene)propyl]-methyl-amino]butanoate Openeye Name: 4-[[(3E)-3-(6H-benzo[c][1]benzoxepin-11-ylidene)propyl]-methyl-amino]butanoate CAS Name: 4-[[(3E)-3-(6H-benzo[c][1]benzoxepin-11-ylidene)propyl]-methylamino]butanoate IUPAC Name: 4-[[(3E)-3-(6H-benzo[c][1]benzoxepin-11-ylidene)propyl]-methylamino]butanoate Traditional Name: 4-[[(3E)-3-(6H-benzo[c][1]benzoxepin-11-ylidene)propyl]-methyl-amino]butyrate Formula: C22H24NO3- MolecularWeight: 350.43086

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H25NO3/c1-23(15-7-13-22(24)25)14-6-11-19-18-9-3-2-8-17(18)16-26-21-12-5-4-10-20(19)21/h2-5,8-12H,6-7,13-16H2,1H3,(H,24,25)/p-1/b19-11+