3-(1-hexyl-2-methyl-indol-3-yl)-4-(2-methyl-1-propyl-indol-3-yl)-1-(phenylmethyl)pyrrole-2,5-dione

Systemtic Name: 3-(1-hexyl-2-methyl-indol-3-yl)-4-(2-methyl-1-propyl-indol-3-yl)-1-(phenylmethyl)pyrrole-2,5-dione Openeye Name: 1-benzyl-3-(1-hexyl-2-methyl-indol-3-yl)-4-(2-methyl-1-propyl-indol-3-yl)pyrrole-2,5-dione CAS Name: 3-(1-hexyl-2-methyl-3-indolyl)-4-(2-methyl-1-propyl-3-indolyl)-1-(phenylmethyl)pyrrole-2,5-dione IUPAC Name: 1-benzyl-3-(1-hexyl-2-methylindol-3-yl)-4-(2-methyl-1-propylindol-3-yl)pyrrole-2,5-dione Traditional Name: 1-benzyl-3-(1-hexyl-2-methyl-indol-3-yl)-4-(2-methyl-1-propyl-indol-3-yl)-3-pyrroline-2,5-quinone Formula: C38H41N3O2 MolecularWeight: 571.75104

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1C(=C(C2=CC=CC=C21)C3=C(C(=O)N(C3=O)CC4=CC=CC=C4)C5=C(N(C6=CC=CC=C65)CCC)C)C

Isomeric SMILES

CCCCCCN1C(=C(C2=CC=CC=C21)C3=C(C(=O)N(C3=O)CC4=CC=CC=C4)C5=C(N(C6=CC=CC=C65)CCC)C)C

InChI

InChI=1S/C38H41N3O2/c1-5-7-8-16-24-40-27(4)34(30-20-13-15-22-32(30)40)36-35(37(42)41(38(36)43)25-28-17-10-9-11-18-28)33-26(3)39(23-6-2)31-21-14-12-19-29(31)33/h9-15,17-22H,5-8,16,23-25H2,1-4H3