6-[[3-(1H-indol-4-yloxy)-2-oxidanyl-propyl]amino]heptanoic acid

Systemtic Name: 6-[[3-(1H-indol-4-yloxy)-2-oxidanyl-propyl]amino]heptanoic acid Openeye Name: 6-[[2-hydroxy-3-(1H-indol-4-yloxy)propyl]amino]heptanoic acid CAS Name: 6-[[2-hydroxy-3-(1H-indol-4-yloxy)propyl]amino]heptanoic acid IUPAC Name: 6-[[2-hydroxy-3-(1H-indol-4-yloxy)propyl]amino]heptanoic acid Traditional Name: 6-[[2-hydroxy-3-(1H-indol-4-yloxy)propyl]amino]enanthic acid Formula: C18H26N2O4 MolecularWeight: 334.41004

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CCCCC(=O)O)NCC(COC1=CC=CC2=C1C=CN2)O

Isomeric SMILES

CC(CCCCC(=O)O)NCC(COC1=CC=CC2=C1C=CN2)O

InChI

InChI=1S/C18H26N2O4/c1-13(5-2-3-8-18(22)23)20-11-14(21)12-24-17-7-4-6-16-15(17)9-10-19-16/h4,6-7,9-10,13-14,19-21H,2-3,5,8,11-12H2,1H3,(H,22,23)