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

Systemtic Name: 6-methoxy-3-[3-nitro-1,4-bis(oxidanylidene)naphthalen-2-yl]-4-oxidanyl-naphthalene-1,2-dione Openeye Name: 4-hydroxy-6-methoxy-3-(3-nitro-1,4-dioxo-2-naphthyl)naphthalene-1,2-dione CAS Name: 4-hydroxy-6-methoxy-3-(3-nitro-1,4-dioxo-2-naphthalenyl)naphthalene-1,2-dione IUPAC Name: 4-hydroxy-6-methoxy-3-(3-nitro-1,4-dioxonaphthalen-2-yl)naphthalene-1,2-dione Traditional Name: 3-(1,4-diketo-3-nitro-2-naphthyl)-4-hydroxy-6-methoxy-1,2-naphthoquinone Formula: C21H11NO8 MolecularWeight: 405.31394

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(=O)C(=O)C(=C2O)C3=C(C(=O)C4=CC=CC=C4C3=O)[N+](=O)[O-]

Isomeric SMILES

COC1=CC2=C(C=C1)C(=O)C(=O)C(=C2O)C3=C(C(=O)C4=CC=CC=C4C3=O)[N+](=O)[O-]

InChI

InChI=1S/C21H11NO8/c1-30-9-6-7-12-13(8-9)18(24)15(21(27)20(12)26)14-16(22(28)29)19(25)11-5-3-2-4-10(11)17(14)23/h2-8,24H,1H3