Xanthylium, 9-[2-carboxy-6-(2,5-dihydro-2,5-dioxo-1H-pyrrol-1-yl)phenyl]-3,6-bis(dimethylamino)-, inner salt
CAS Registry Number®
174568-68-4
CAS Name
Xanthylium, 9-[2-carboxy-6-(2,5-dihydro-2,5-dioxo-1H-pyrrol-1-yl)phenyl]-3,6-bis(dimethylamino)-, inner saltMolecular Formula
C28H23N3O5Cite this Page
Xanthylium, 9-[2-carboxy-6-(2,5-dihydro-2,5-dioxo-1H-pyrrol-1-yl)phenyl]-3,6-bis(dimethylamino)-, inner salt. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=174568-68-4 (retrieved ) (CAS RN: 174568-68-4). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1S/C28H23N3O5/c1-29(2)16-8-10-18-22(14-16)36-23-15-17(30(3)4)9-11-19(23)26(18)27-20(28(34)35)6-5-7-21(27)31-24(32)12-13-25(31)33/h5-15H,1-4H3
InChIKey
InChIKey=SHKRXDBVQOSKJN-UHFFFAOYSA-N
SMILES
C([O-])(=O)C=1C(C=2C3=C([O+]=C4C2C=CC(N(C)C)=C4)C=C(N(C)C)C=C3)=C(C=CC1)N5C(=O)C=CC5=O
Canonical SMILES
O=C([O-])C1=CC=CC(=C1C=2C=3C=CC(=CC3[O+]=C4C=C(C=CC42)N(C)C)N(C)C)N5C(=O)C=CC5=O
Other Names for this Substance
- Xanthylium, 9-[2-carboxy-6-(2,5-dihydro-2,5-dioxo-1H-pyrrol-1-yl)phenyl]-3,6-bis(dimethylamino)-, inner salt