3-(1H-indol-3-yl)-1-(4-oxidanylbutyl)-4-phenylazanyl-pyrrole-2,5-dione

Systemtic Name: 3-(1H-indol-3-yl)-1-(4-oxidanylbutyl)-4-phenylazanyl-pyrrole-2,5-dione Openeye Name: 3-anilino-1-(4-hydroxybutyl)-4-(1H-indol-3-yl)pyrrole-2,5-dione CAS Name: 3-anilino-1-(4-hydroxybutyl)-4-(1H-indol-3-yl)pyrrole-2,5-dione IUPAC Name: 3-anilino-1-(4-hydroxybutyl)-4-(1H-indol-3-yl)pyrrole-2,5-dione Traditional Name: 3-anilino-1-(4-hydroxybutyl)-4-(1H-indol-3-yl)-3-pyrroline-2,5-quinone Formula: C22H21N3O3 MolecularWeight: 375.42044

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC2=C(C(=O)N(C2=O)CCCCO)C3=CNC4=CC=CC=C43

Isomeric SMILES

C1=CC=C(C=C1)NC2=C(C(=O)N(C2=O)CCCCO)C3=CNC4=CC=CC=C43

InChI

InChI=1S/C22H21N3O3/c26-13-7-6-12-25-21(27)19(17-14-23-18-11-5-4-10-16(17)18)20(22(25)28)24-15-8-2-1-3-9-15/h1-5,8-11,14,23-24,26H,6-7,12-13H2