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

Systemtic Name: 2-(3-methoxy-5-nitro-4-prop-2-enoxy-phenyl)-4-(3,4,5-trimethoxyphenyl)-1,3-dithiolane Openeye Name: 2-(4-allyloxy-3-methoxy-5-nitro-phenyl)-4-(3,4,5-trimethoxyphenyl)-1,3-dithiolane CAS Name: 2-(3-methoxy-5-nitro-4-prop-2-enoxyphenyl)-4-(3,4,5-trimethoxyphenyl)-1,3-dithiolane IUPAC Name: 2-(3-methoxy-5-nitro-4-prop-2-enoxyphenyl)-4-(3,4,5-trimethoxyphenyl)-1,3-dithiolane Traditional Name: 2-(4-allyloxy-3-methoxy-5-nitro-phenyl)-4-(3,4,5-trimethoxyphenyl)-1,3-dithiolane Formula: C22H25NO7S2 MolecularWeight: 479.5664

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C2CSC(S2)C3=CC(=C(C(=C3)OC)OCC=C)[N+](=O)[O-]

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C2CSC(S2)C3=CC(=C(C(=C3)OC)OCC=C)[N+](=O)[O-]

InChI

InChI=1S/C22H25NO7S2/c1-6-7-30-20-15(23(24)25)8-14(11-16(20)26-2)22-31-12-19(32-22)13-9-17(27-3)21(29-5)18(10-13)28-4/h6,8-11,19,22H,1,7,12H2,2-5H3