7-bromanyl-1-(3,4-dimethoxyphenyl)-2-(3-oxidanylpropyl)-1H-chromeno[2,3-c]pyrrole-3,9-dione

Systemtic Name: 7-bromanyl-1-(3,4-dimethoxyphenyl)-2-(3-oxidanylpropyl)-1H-chromeno[2,3-c]pyrrole-3,9-dione Openeye Name: 7-bromo-1-(3,4-dimethoxyphenyl)-2-(3-hydroxypropyl)-1H-chromeno[2,3-c]pyrrole-3,9-dione CAS Name: 7-bromo-1-(3,4-dimethoxyphenyl)-2-(3-hydroxypropyl)-1H-[1]benzopyrano[2,3-c]pyrrole-3,9-dione IUPAC Name: 7-bromo-1-(3,4-dimethoxyphenyl)-2-(3-hydroxypropyl)-1H-chromeno[2,3-c]pyrrole-3,9-dione Traditional Name: 7-bromo-1-(3,4-dimethoxyphenyl)-2-(3-hydroxypropyl)-1H-chromeno[2,3-c]pyrrole-3,9-quinone Formula: C22H20BrNO6 MolecularWeight: 474.3013

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2C3=C(C(=O)N2CCCO)OC4=C(C3=O)C=C(C=C4)Br)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2C3=C(C(=O)N2CCCO)OC4=C(C3=O)C=C(C=C4)Br)OC

InChI

InChI=1S/C22H20BrNO6/c1-28-16-6-4-12(10-17(16)29-2)19-18-20(26)14-11-13(23)5-7-15(14)30-21(18)22(27)24(19)8-3-9-25/h4-7,10-11,19,25H,3,8-9H2,1-2H3