2-(1,3-benzodioxol-5-ylmethyl)-1-(4-butoxy-3-ethoxy-phenyl)-7-fluoranyl-1H-chromeno[2,3-c]pyrrole-3,9-dione

Systemtic Name: 2-(1,3-benzodioxol-5-ylmethyl)-1-(4-butoxy-3-ethoxy-phenyl)-7-fluoranyl-1H-chromeno[2,3-c]pyrrole-3,9-dione Openeye Name: 2-(1,3-benzodioxol-5-ylmethyl)-1-(4-butoxy-3-ethoxy-phenyl)-7-fluoro-1H-chromeno[2,3-c]pyrrole-3,9-dione CAS Name: 2-(1,3-benzodioxol-5-ylmethyl)-1-(4-butoxy-3-ethoxyphenyl)-7-fluoro-1H-[1]benzopyrano[2,3-c]pyrrole-3,9-dione IUPAC Name: 2-(1,3-benzodioxol-5-ylmethyl)-1-(4-butoxy-3-ethoxyphenyl)-7-fluoro-1H-chromeno[2,3-c]pyrrole-3,9-dione Traditional Name: 1-(4-butoxy-3-ethoxy-phenyl)-7-fluoro-2-piperonyl-1H-chromeno[2,3-c]pyrrole-3,9-quinone Formula: C31H28FNO7 MolecularWeight: 545.554923

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)C2C3=C(C(=O)N2CC4=CC5=C(C=C4)OCO5)OC6=C(C3=O)C=C(C=C6)F)OCC

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)C2C3=C(C(=O)N2CC4=CC5=C(C=C4)OCO5)OC6=C(C3=O)C=C(C=C6)F)OCC

InChI

InChI=1S/C31H28FNO7/c1-3-5-12-37-23-10-7-19(14-26(23)36-4-2)28-27-29(34)21-15-20(32)8-11-22(21)40-30(27)31(35)33(28)16-18-6-9-24-25(13-18)39-17-38-24/h6-11,13-15,28H,3-5,12,16-17H2,1-2H3