2,6-dimethoxy-3-[3-nitro-1,4-bis(oxidanylidene)naphthalen-2-yl]naphthalene-1,4-dione

Systemtic Name: 2,6-dimethoxy-3-[3-nitro-1,4-bis(oxidanylidene)naphthalen-2-yl]naphthalene-1,4-dione Openeye Name: 2,6-dimethoxy-3-(3-nitro-1,4-dioxo-2-naphthyl)naphthalene-1,4-dione CAS Name: 2,6-dimethoxy-3-(3-nitro-1,4-dioxo-2-naphthalenyl)naphthalene-1,4-dione IUPAC Name: 2,6-dimethoxy-3-(3-nitro-1,4-dioxonaphthalen-2-yl)naphthalene-1,4-dione Traditional Name: 3-(1,4-diketo-3-nitro-2-naphthyl)-2,6-dimethoxy-1,4-naphthoquinone Formula: C22H13NO8 MolecularWeight: 419.34052

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(=O)C(=C(C2=O)C3=C(C(=O)C4=CC=CC=C4C3=O)[N+](=O)[O-])OC

Isomeric SMILES

COC1=CC2=C(C=C1)C(=O)C(=C(C2=O)C3=C(C(=O)C4=CC=CC=C4C3=O)[N+](=O)[O-])OC

InChI

InChI=1S/C22H13NO8/c1-30-10-7-8-13-14(9-10)19(25)16(22(31-2)21(13)27)15-17(23(28)29)20(26)12-6-4-3-5-11(12)18(15)24/h3-9H,1-2H3