N-(5-methoxy-9-oxidanylidene-xanthen-3-yl)-3-nitro-benzamide

Systemtic Name: N-(5-methoxy-9-oxidanylidene-xanthen-3-yl)-3-nitro-benzamide Openeye Name: N-(5-methoxy-9-oxo-xanthen-3-yl)-3-nitro-benzamide CAS Name: N-(5-methoxy-9-oxo-3-xanthenyl)-3-nitrobenzamide IUPAC Name: N-(5-methoxy-9-oxoxanthen-3-yl)-3-nitrobenzamide Traditional Name: N-(9-keto-5-methoxy-xanthen-3-yl)-3-nitro-benzamide Formula: C21H14N2O6 MolecularWeight: 390.34566

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC2=C1OC3=C(C2=O)C=CC(=C3)NC(=O)C4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=CC2=C1OC3=C(C2=O)C=CC(=C3)NC(=O)C4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H14N2O6/c1-28-17-7-3-6-16-19(24)15-9-8-13(11-18(15)29-20(16)17)22-21(25)12-4-2-5-14(10-12)23(26)27/h2-11H,1H3,(H,22,25)