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ethyl 2-[3-(ethylamino)-6-ethylimino-2,7-dimethyl-xanthen-9-yl]benzoate; fluoranylboronic acid; hydrochloride
ethyl 2-[3-(ethylamino)-6-ethylimino-2,7-dimethyl-xanthen-9-yl]benzoate; fluoranylboronic acid; hydrochloride
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Canonical SMILES:
B(O)(O)F.B(O)(O)F.B(O)(O)F.B(O)(O)F.CCNC1=C(C=C2C(=C1)OC3=CC(=NCC)C(=CC3=C2C4=CC=CC=C4C(=O)OCC)C)C.Cl
Isomeric SMILES
B(O)(O)F.B(O)(O)F.B(O)(O)F.B(O)(O)F.CCNC1=C(C=C2C(=C1)OC3=CC(=NCC)C(=CC3=C2C4=CC=CC=C4C(=O)OCC)C)C.Cl
InChI
InChI=1S/C28H30N2O3.4BFH2O2.ClH/c1-6-29-23-15-25-21(13-17(23)4)27(19-11-9-10-12-20(19)28(31)32-8-3)22-14-18(5)24(30-7-2)16-26(22)33-25;4*2-1(3)4;/h9-16,29H,6-8H2,1-5H3;4*3-4H;1H
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