3-[1-(furan-2-yl)-2-nitro-ethyl]-4-oxidanyl-naphthalene-1,2-dione

Systemtic Name: 3-[1-(furan-2-yl)-2-nitro-ethyl]-4-oxidanyl-naphthalene-1,2-dione Openeye Name: 3-[1-(2-furyl)-2-nitro-ethyl]-4-hydroxy-naphthalene-1,2-dione CAS Name: 3-[1-(2-furanyl)-2-nitroethyl]-4-hydroxynaphthalene-1,2-dione IUPAC Name: 3-[1-(furan-2-yl)-2-nitroethyl]-4-hydroxynaphthalene-1,2-dione Traditional Name: 3-[1-(2-furyl)-2-nitro-ethyl]-4-hydroxy-1,2-naphthoquinone Formula: C16H11NO6 MolecularWeight: 313.26164

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=C(C(=O)C2=O)C(C[N+](=O)[O-])C3=CC=CO3)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=C(C(=O)C2=O)C(C[N+](=O)[O-])C3=CC=CO3)O

InChI

InChI=1S/C16H11NO6/c18-14-9-4-1-2-5-10(9)15(19)16(20)13(14)11(8-17(21)22)12-6-3-7-23-12/h1-7,11,18H,8H2