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N-{6-[(9H-xanthen-9-ylcarbonyl)amino]-2-pyridinyl}-9H-xanthene-9-carboxamide

View entire compound with spectra: 2 NMR

N-{6-[(9H-xanthen-9-ylcarbonyl)amino]-2-pyridinyl}-9H-xanthene-9-carboxamide
SpectraBase Compound ID 7mQfwC7Pdm0
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)
InChIKey GRVSPPVVWCCSCC-UHFFFAOYSA-N
Mol Weight 525.6 g/mol
Molecular Formula C33H23N3O4
Exact Mass 525.168856 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3evGk6FDRUW
Name N-{6-[(9H-Xanthen-9-ylcarbonyl)amino]-2-pyridinyl}-9H-xanthene-9-carboxamide
Comments Computed using HOSE algorithm
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Exact Mass 525.168856229 u
Formula C33H23N3O4
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)
InChIKey GRVSPPVVWCCSCC-UHFFFAOYSA-N
Molecular Weight 525.564 g/mol
SMILES N(C(C1C2=C(C=CC=C2)OC2=C1C=CC=C2)=O)C=1N=C(NC(C2C3=C(C=CC=C3)OC3=C2C=CC=C3)=O)C=CC1