1-(2-aminophenyl)-3-azanyl-3-(4-azanylbutyl)-5-(5-oxidanyl-1H-indol-3-yl)pentane-2,4-dione

Systemtic Name: 1-(2-aminophenyl)-3-azanyl-3-(4-azanylbutyl)-5-(5-oxidanyl-1H-indol-3-yl)pentane-2,4-dione Openeye Name: 3-amino-3-(4-aminobutyl)-1-(2-aminophenyl)-5-(5-hydroxy-1H-indol-3-yl)pentane-2,4-dione CAS Name: 3-amino-3-(4-aminobutyl)-1-(2-aminophenyl)-5-(5-hydroxy-1H-indol-3-yl)pentane-2,4-dione IUPAC Name: 3-amino-3-(4-aminobutyl)-1-(2-aminophenyl)-5-(5-hydroxy-1H-indol-3-yl)pentane-2,4-dione Traditional Name: 3-amino-3-(4-aminobutyl)-1-(2-aminophenyl)-5-(5-hydroxy-1H-indol-3-yl)pentane-2,4-dione Formula: C23H28N4O3 MolecularWeight: 408.49342

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CC(=O)C(CCCCN)(C(=O)CC2=CNC3=C2C=C(C=C3)O)N)N

Isomeric SMILES

C1=CC=C(C(=C1)CC(=O)C(CCCCN)(C(=O)CC2=CNC3=C2C=C(C=C3)O)N)N

InChI

InChI=1S/C23H28N4O3/c24-10-4-3-9-23(26,21(29)11-15-5-1-2-6-19(15)25)22(30)12-16-14-27-20-8-7-17(28)13-18(16)20/h1-2,5-8,13-14,27-28H,3-4,9-12,24-26H2