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

Systemtic Name: 1-(3-methoxy-5-nitro-4-prop-2-enoxy-phenyl)-4-(3,4,5-trimethoxyphenyl)butane-1,4-diol Openeye Name: 1-(4-allyloxy-3-methoxy-5-nitro-phenyl)-4-(3,4,5-trimethoxyphenyl)butane-1,4-diol CAS Name: 1-(3-methoxy-5-nitro-4-prop-2-enoxyphenyl)-4-(3,4,5-trimethoxyphenyl)butane-1,4-diol IUPAC Name: 1-(3-methoxy-5-nitro-4-prop-2-enoxyphenyl)-4-(3,4,5-trimethoxyphenyl)butane-1,4-diol Traditional Name: 1-(4-allyloxy-3-methoxy-5-nitro-phenyl)-4-(3,4,5-trimethoxyphenyl)butane-1,4-diol Formula: C23H29NO9 MolecularWeight: 463.47766

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H29NO9/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/h6,10-13,17-18,25-26H,1,7-9H2,2-5H3