2-[1-(1-nitroethyl)-9H-xanthen-9-yl]ethanoate

Systemtic Name: 2-[1-(1-nitroethyl)-9H-xanthen-9-yl]ethanoate Openeye Name: 2-[1-(1-nitroethyl)-9H-xanthen-9-yl]acetate CAS Name: 2-[1-(1-nitroethyl)-9H-xanthen-9-yl]acetate IUPAC Name: 2-[1-(1-nitroethyl)-9H-xanthen-9-yl]acetate Traditional Name: 2-[1-(1-nitroethyl)-9H-xanthen-9-yl]acetate Formula: C17H14NO5- MolecularWeight: 312.29676

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=C2C(C3=CC=CC=C3OC2=CC=C1)CC(=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC(C1=C2C(C3=CC=CC=C3OC2=CC=C1)CC(=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C17H15NO5/c1-10(18(21)22)11-6-4-8-15-17(11)13(9-16(19)20)12-5-2-3-7-14(12)23-15/h2-8,10,13H,9H2,1H3,(H,19,20)/p-1