1-(3-methoxy-5-nitro-4-prop-2-enoxy-phenyl)-4-(3,4,5-trimethoxyphenyl)butane-1,4-dione

Systemtic Name: 1-(3-methoxy-5-nitro-4-prop-2-enoxy-phenyl)-4-(3,4,5-trimethoxyphenyl)butane-1,4-dione Openeye Name: 1-(4-allyloxy-3-methoxy-5-nitro-phenyl)-4-(3,4,5-trimethoxyphenyl)butane-1,4-dione CAS Name: 1-(3-methoxy-5-nitro-4-prop-2-enoxyphenyl)-4-(3,4,5-trimethoxyphenyl)butane-1,4-dione IUPAC Name: 1-(3-methoxy-5-nitro-4-prop-2-enoxyphenyl)-4-(3,4,5-trimethoxyphenyl)butane-1,4-dione Traditional Name: 1-(4-allyloxy-3-methoxy-5-nitro-phenyl)-4-(3,4,5-trimethoxyphenyl)butane-1,4-dione Formula: C23H25NO9 MolecularWeight: 459.4459

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OCC=C)[N+](=O)[O-])C(=O)CCC(=O)C2=CC(=C(C(=C2)OC)OC)OC

Isomeric SMILES

COC1=CC(=CC(=C1OCC=C)[N+](=O)[O-])C(=O)CCC(=O)C2=CC(=C(C(=C2)OC)OC)OC

InChI

InChI=1S/C23H25NO9/c1-6-9-33-22-16(24(27)28)10-14(11-19(22)29-2)17(25)7-8-18(26)15-12-20(30-3)23(32-5)21(13-15)31-4/h6,10-13H,1,7-9H2,2-5H3