1-[4-(2-hydroxyethyloxy)-3-methoxy-5-nitro-phenyl]-4-(3,4,5-trimethoxyphenyl)butane-1,4-dione

Systemtic Name: 1-[4-(2-hydroxyethyloxy)-3-methoxy-5-nitro-phenyl]-4-(3,4,5-trimethoxyphenyl)butane-1,4-dione Openeye Name: 1-[4-(2-hydroxyethoxy)-3-methoxy-5-nitro-phenyl]-4-(3,4,5-trimethoxyphenyl)butane-1,4-dione CAS Name: 1-[4-(2-hydroxyethoxy)-3-methoxy-5-nitrophenyl]-4-(3,4,5-trimethoxyphenyl)butane-1,4-dione IUPAC Name: 1-[4-(2-hydroxyethoxy)-3-methoxy-5-nitrophenyl]-4-(3,4,5-trimethoxyphenyl)butane-1,4-dione Traditional Name: 1-[4-(2-hydroxyethoxy)-3-methoxy-5-nitro-phenyl]-4-(3,4,5-trimethoxyphenyl)butane-1,4-dione Formula: C22H25NO10 MolecularWeight: 463.4346

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OCCO)[N+](=O)[O-])C(=O)CCC(=O)C2=CC(=C(C(=C2)OC)OC)OC

Isomeric SMILES

COC1=CC(=CC(=C1OCCO)[N+](=O)[O-])C(=O)CCC(=O)C2=CC(=C(C(=C2)OC)OC)OC

InChI

InChI=1S/C22H25NO10/c1-29-18-10-13(9-15(23(27)28)21(18)33-8-7-24)16(25)5-6-17(26)14-11-19(30-2)22(32-4)20(12-14)31-3/h9-12,24H,5-8H2,1-4H3