| PDB CCD ID: | V8C |
| Number of entries in FURNA: | 3 |
| Chemical formula: | C25 H23 N3 O4 |
| InChI: | InChI=1S/C25H23N3O4/c1-27(2)15-6-9-18-21(12-15)32-22-13-16(28(3)4)7-10-19(22)23(18)17-8-5-14(24(26)29)11-20(17)25(30)31/h5-13H,1-4H3,(H2-,26,29,30,31) |
| InChIKey: | TZKHAYIVKGBSEZ-UHFFFAOYSA-N |
| SMILES: | CN(C)c1ccc2c(OC3=CC(C=CC3=C2c4ccc(cc4C([O-])=O)C(N)=O)=[N+](C)C)c1; CN(C)c1ccc2c(c1)OC3=CC(=[N+](C)C)C=CC3=C2c4ccc(cc4C(=O)[O-])C(=O)N |
| Name: | 5-aminocarbonyl-2-[3-(dimethylamino)-6-dimethylazaniumylidene-xanthen-9-yl]benzoate |
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