3-bromanyl-4-[5-butoxy-2-(4-methoxyphenyl)-1H-indol-3-yl]pyrrole-2,5-dione

Systemtic Name: 3-bromanyl-4-[5-butoxy-2-(4-methoxyphenyl)-1H-indol-3-yl]pyrrole-2,5-dione Openeye Name: 3-bromo-4-[5-butoxy-2-(4-methoxyphenyl)-1H-indol-3-yl]pyrrole-2,5-dione CAS Name: 3-bromo-4-[5-butoxy-2-(4-methoxyphenyl)-1H-indol-3-yl]pyrrole-2,5-dione IUPAC Name: 3-bromo-4-[5-butoxy-2-(4-methoxyphenyl)-1H-indol-3-yl]pyrrole-2,5-dione Traditional Name: 3-bromo-4-[5-butoxy-2-(4-methoxyphenyl)-1H-indol-3-yl]-3-pyrroline-2,5-quinone Formula: C23H21BrN2O4 MolecularWeight: 469.32784

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC2=C(C=C1)NC(=C2C3=C(C(=O)NC3=O)Br)C4=CC=C(C=C4)OC

Isomeric SMILES

CCCCOC1=CC2=C(C=C1)NC(=C2C3=C(C(=O)NC3=O)Br)C4=CC=C(C=C4)OC

InChI

InChI=1S/C23H21BrN2O4/c1-3-4-11-30-15-9-10-17-16(12-15)18(19-20(24)23(28)26-22(19)27)21(25-17)13-5-7-14(29-2)8-6-13/h5-10,12,25H,3-4,11H2,1-2H3,(H,26,27,28)