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5-[2,5-bis(oxidanylidene)pyrrol-1-yl]-2-[3-(dimethylamino)-6-dimethylazaniumylidene-xanthen-9-yl]benzoate

5-[2,5-bis(oxidanylidene)pyrrol-1-yl]-2-[3-(dimethylamino)-6-dimethylazaniumylidene-xanthen-9-yl]benzoate

Systemtic Name:5-[2,5-bis(oxidanylidene)pyrrol-1-yl]-2-[3-(dimethylamino)-6-dimethylazaniumylidene-xanthen-9-yl]benzoate
Openeye Name:2-[3-(dimethylamino)-6-dimethyliminio-xanthen-9-yl]-5-(2,5-dioxopyrrol-1-yl)benzoate
CAS Name:2-[3-(dimethylamino)-6-dimethyliminio-9-xanthenyl]-5-(2,5-dioxo-1-pyrrolyl)benzoate
IUPAC Name:2-[3-(dimethylamino)-6-dimethylazaniumylidenexanthen-9-yl]-5-(2,5-dioxopyrrol-1-yl)benzoate
Traditional Name:2-[3-(dimethylamino)-6-dimethyliminio-xanthen-9-yl]-5-maleimido-benzoate
Formula: C28H23N3O5
MolecularWeight: 481.49932
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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC2=C(C=C1)C(=C3C=CC(=[N+](C)C)C=C3O2)C4=C(C=C(C=C4)N5C(=O)C=CC5=O)C(=O)[O-]


Isomeric SMILES

CN(C)C1=CC2=C(C=C1)C(=C3C=CC(=[N+](C)C)C=C3O2)C4=C(C=C(C=C4)N5C(=O)C=CC5=O)C(=O)[O-]


InChI

InChI=1S/C28H23N3O5/c1-29(2)16-5-9-20-23(14-16)36-24-15-17(30(3)4)6-10-21(24)27(20)19-8-7-18(13-22(19)28(34)35)31-25(32)11-12-26(31)33/h5-15H,1-4H3


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