3-methyl-2,7-dinitro-xanthen-9-one

Systemtic Name: 3-methyl-2,7-dinitro-xanthen-9-one Openeye Name: 3-methyl-2,7-dinitro-xanthen-9-one CAS Name: 3-methyl-2,7-dinitro-9-xanthenone IUPAC Name: 3-methyl-2,7-dinitroxanthen-9-one Traditional Name: 3-methyl-2,7-dinitro-xanthone Formula: C14H8N2O6 MolecularWeight: 300.22312

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)OC3=C(C2=O)C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C2C(=C1)OC3=C(C2=O)C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C14H8N2O6/c1-7-4-13-10(6-11(7)16(20)21)14(17)9-5-8(15(18)19)2-3-12(9)22-13/h2-6H,1H3