N-[[3-[3-(5-carbamimidoyl-1H-indol-2-yl)-2-oxidanyl-phenyl]-4-oxidanyl-phenyl]methyl]hexanamide

Systemtic Name: N-[[3-[3-(5-carbamimidoyl-1H-indol-2-yl)-2-oxidanyl-phenyl]-4-oxidanyl-phenyl]methyl]hexanamide Openeye Name: N-[[3-[3-(5-carbamimidoyl-1H-indol-2-yl)-2-hydroxy-phenyl]-4-hydroxy-phenyl]methyl]hexanamide CAS Name: N-[[3-[3-(5-carbamimidoyl-1H-indol-2-yl)-2-hydroxyphenyl]-4-hydroxyphenyl]methyl]hexanamide IUPAC Name: N-[[3-[3-(5-carbamimidoyl-1H-indol-2-yl)-2-hydroxyphenyl]-4-hydroxyphenyl]methyl]hexanamide Traditional Name: N-[3-[3-(5-amidino-1H-indol-2-yl)-2-hydroxy-phenyl]-4-hydroxy-benzyl]hexanamide Formula: C28H30N4O3 MolecularWeight: 470.5628

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)NCC1=CC(=C(C=C1)O)C2=C(C(=CC=C2)C3=CC4=C(N3)C=CC(=C4)C(=N)N)O

Isomeric SMILES

CCCCCC(=O)NCC1=CC(=C(C=C1)O)C2=C(C(=CC=C2)C3=CC4=C(N3)C=CC(=C4)C(=N)N)O

InChI

InChI=1S/C28H30N4O3/c1-2-3-4-8-26(34)31-16-17-9-12-25(33)22(13-17)20-6-5-7-21(27(20)35)24-15-19-14-18(28(29)30)10-11-23(19)32-24/h5-7,9-15,32-33,35H,2-4,8,16H2,1H3,(H3,29,30)(H,31,34)