N'-[6-azanylidene-9-(4-fluoranyl-3-methyl-phenyl)xanthen-3-yl]-N'-ethyl-N,N-dimethyl-propane-1,3-diamine

Systemtic Name: N'-[6-azanylidene-9-(4-fluoranyl-3-methyl-phenyl)xanthen-3-yl]-N'-ethyl-N,N-dimethyl-propane-1,3-diamine Openeye Name: N'-ethyl-N'-[9-(4-fluoro-3-methyl-phenyl)-6-imino-xanthen-3-yl]-N,N-dimethyl-propane-1,3-diamine CAS Name: N'-ethyl-N'-[9-(4-fluoro-3-methylphenyl)-6-imino-3-xanthenyl]-N,N-dimethylpropane-1,3-diamine IUPAC Name: N'-ethyl-N'-[9-(4-fluoro-3-methylphenyl)-6-iminoxanthen-3-yl]-N,N-dimethylpropane-1,3-diamine Traditional Name: 3-(dimethylamino)propyl-ethyl-[9-(4-fluoro-3-methyl-phenyl)-6-imino-xanthen-3-yl]amine Formula: C27H30FN3O MolecularWeight: 431.545003

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CCCN(C)C)C1=CC2=C(C=C1)C(=C3C=CC(=N)C=C3O2)C4=CC(=C(C=C4)F)C

Isomeric SMILES

CCN(CCCN(C)C)C1=CC2=C(C=C1)C(=C3C=CC(=N)C=C3O2)C4=CC(=C(C=C4)F)C

InChI

InChI=1S/C27H30FN3O/c1-5-31(14-6-13-30(3)4)21-9-11-23-26(17-21)32-25-16-20(29)8-10-22(25)27(23)19-7-12-24(28)18(2)15-19/h7-12,15-17,29H,5-6,13-14H2,1-4H3