butyl-[4-(oxan-2-yloxy)butyl]-(1H-pyrrol-2-ylmethyl)-[3-(1H-pyrrol-2-ylmethylamino)propyl]azanium

Systemtic Name: butyl-[4-(oxan-2-yloxy)butyl]-(1H-pyrrol-2-ylmethyl)-[3-(1H-pyrrol-2-ylmethylamino)propyl]azanium Openeye Name: butyl-(1H-pyrrol-2-ylmethyl)-[3-(1H-pyrrol-2-ylmethylamino)propyl]-(4-tetrahydropyran-2-yloxybutyl)ammonium CAS Name: butyl-[4-(2-oxanyloxy)butyl]-(1H-pyrrol-2-ylmethyl)-[3-(1H-pyrrol-2-ylmethylamino)propyl]ammonium IUPAC Name: butyl-[4-(oxan-2-yloxy)butyl]-(1H-pyrrol-2-ylmethyl)-[3-(1H-pyrrol-2-ylmethylamino)propyl]azanium Traditional Name: butyl-(1H-pyrrol-2-ylmethyl)-[3-(1H-pyrrol-2-ylmethylamino)propyl]-(4-tetrahydropyran-2-yloxybutyl)ammonium Formula: C26H45N4O2+ MolecularWeight: 445.6611

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[N+](CCCCOC1CCCCO1)(CCCNCC2=CC=CN2)CC3=CC=CN3

Isomeric SMILES

CCCC[N+](CCCCOC1CCCCO1)(CCCNCC2=CC=CN2)CC3=CC=CN3

InChI

InChI=1S/C26H45N4O2/c1-2-3-17-30(23-25-12-9-16-29-25,19-10-14-27-22-24-11-8-15-28-24)18-5-7-21-32-26-13-4-6-20-31-26/h8-9,11-12,15-16,26-29H,2-7,10,13-14,17-23H2,1H3/q+1