2-[5-(4-azaniumylbutanoyloxy)-1H-indol-3-yl]ethylazanium

Systemtic Name: 2-[5-(4-azaniumylbutanoyloxy)-1H-indol-3-yl]ethylazanium Openeye Name: 2-[5-(4-azaniumylbutanoyloxy)-1H-indol-3-yl]ethylammonium CAS Name: [4-[[3-(2-ammonioethyl)-1H-indol-5-yl]oxy]-4-oxobutyl]ammonium IUPAC Name: 2-[5-(4-azaniumylbutanoyloxy)-1H-indol-3-yl]ethylazanium Traditional Name: 2-[5-(4-ammoniobutanoyloxy)-1H-indol-3-yl]ethylammonium Formula: C14H21N3O2+2 MolecularWeight: 263.33544

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1OC(=O)CCC[NH3+])C(=CN2)CC[NH3+]

Isomeric SMILES

C1=CC2=C(C=C1OC(=O)CCC[NH3+])C(=CN2)CC[NH3+]

InChI

InChI=1S/C14H19N3O2/c15-6-1-2-14(18)19-11-3-4-13-12(8-11)10(5-7-16)9-17-13/h3-4,8-9,17H,1-2,5-7,15-16H2/p+2