3,4-bis(1-heptylindol-3-yl)-1-methyl-pyrrole-2,5-dione

Systemtic Name: 3,4-bis(1-heptylindol-3-yl)-1-methyl-pyrrole-2,5-dione Openeye Name: 3,4-bis(1-heptylindol-3-yl)-1-methyl-pyrrole-2,5-dione CAS Name: 3,4-bis(1-heptyl-3-indolyl)-1-methylpyrrole-2,5-dione IUPAC Name: 3,4-bis(1-heptylindol-3-yl)-1-methylpyrrole-2,5-dione Traditional Name: 3,4-bis(1-heptylindol-3-yl)-1-methyl-3-pyrroline-2,5-quinone Formula: C35H43N3O2 MolecularWeight: 537.73482

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCN1C=C(C2=CC=CC=C21)C3=C(C(=O)N(C3=O)C)C4=CN(C5=CC=CC=C54)CCCCCCC

Isomeric SMILES

CCCCCCCN1C=C(C2=CC=CC=C21)C3=C(C(=O)N(C3=O)C)C4=CN(C5=CC=CC=C54)CCCCCCC

InChI

InChI=1S/C35H43N3O2/c1-4-6-8-10-16-22-37-24-28(26-18-12-14-20-30(26)37)32-33(35(40)36(3)34(32)39)29-25-38(23-17-11-9-7-5-2)31-21-15-13-19-27(29)31/h12-15,18-21,24-25H,4-11,16-17,22-23H2,1-3H3