N-[6-(9H-xanthen-9-ylcarbonylamino)pyridin-1-ium-2-yl]-9H-xanthene-9-carboxamide

Systemtic Name: N-[6-(9H-xanthen-9-ylcarbonylamino)pyridin-1-ium-2-yl]-9H-xanthene-9-carboxamide Openeye Name: N-[6-(9H-xanthene-9-carbonylamino)pyridin-1-ium-2-yl]-9H-xanthene-9-carboxamide CAS Name: N-[6-[[oxo(9H-xanthen-9-yl)methyl]amino]-2-pyridin-1-iumyl]-9H-xanthene-9-carboxamide IUPAC Name: N-[6-(9H-xanthene-9-carbonylamino)pyridin-1-ium-2-yl]-9H-xanthene-9-carboxamide Traditional Name: N-[6-(9H-xanthene-9-carbonylamino)pyridin-1-ium-2-yl]-9H-xanthene-9-carboxamide Formula: C33H24N3O4+ MolecularWeight: 526.56136

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(C3=CC=CC=C3O2)C(=O)NC4=[NH+]C(=CC=C4)NC(=O)C5C6=CC=CC=C6OC7=CC=CC=C57

Isomeric SMILES

C1=CC=C2C(=C1)C(C3=CC=CC=C3O2)C(=O)NC4=[NH+]C(=CC=C4)NC(=O)C5C6=CC=CC=C6OC7=CC=CC=C57

InChI

InChI=1S/C33H23N3O4/c37-32(30-20-10-1-5-14-24(20)39-25-15-6-2-11-21(25)30)35-28-18-9-19-29(34-28)36-33(38)31-22-12-3-7-16-26(22)40-27-17-8-4-13-23(27)31/h1-19,30-31H,(H2,34,35,36,37,38)/p+1