1-[2-[2-(1H-indol-3-yl)ethylamino]-2-oxidanylidene-ethyl]-4-piperidin-1-ium-1-yl-piperidin-1-ium-4-carboxamide

Systemtic Name: 1-[2-[2-(1H-indol-3-yl)ethylamino]-2-oxidanylidene-ethyl]-4-piperidin-1-ium-1-yl-piperidin-1-ium-4-carboxamide Openeye Name: 1-[2-[2-(1H-indol-3-yl)ethylamino]-2-oxo-ethyl]-4-piperidin-1-ium-1-yl-piperidin-1-ium-4-carboxamide CAS Name: 1-[2-[2-(1H-indol-3-yl)ethylamino]-2-oxoethyl]-4-(1-piperidin-1-iumyl)-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[2-[2-(1H-indol-3-yl)ethylamino]-2-oxoethyl]-4-piperidin-1-ium-1-ylpiperidin-1-ium-4-carboxamide Traditional Name: 1-[2-[2-(1H-indol-3-yl)ethylamino]-2-keto-ethyl]-4-piperidin-1-ium-1-yl-piperidin-1-ium-4-carboxamide Formula: C23H35N5O2+2 MolecularWeight: 413.5563

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)C2(CC[NH+](CC2)CC(=O)NCCC3=CNC4=CC=CC=C43)C(=O)N

Isomeric SMILES

C1CC[NH+](CC1)C2(CC[NH+](CC2)CC(=O)NCCC3=CNC4=CC=CC=C43)C(=O)N

InChI

InChI=1S/C23H33N5O2/c24-22(30)23(28-12-4-1-5-13-28)9-14-27(15-10-23)17-21(29)25-11-8-18-16-26-20-7-3-2-6-19(18)20/h2-3,6-7,16,26H,1,4-5,8-15,17H2,(H2,24,30)(H,25,29)/p+2