3-[4-(4-butanoylpiperazin-1-yl)phenoxy]propylazanium

Systemtic Name: 3-[4-(4-butanoylpiperazin-1-yl)phenoxy]propylazanium Openeye Name: 3-[4-(4-butanoylpiperazin-1-yl)phenoxy]propylammonium CAS Name: 3-[4-[4-(1-oxobutyl)-1-piperazinyl]phenoxy]propylammonium IUPAC Name: 3-[4-(4-butanoylpiperazin-1-yl)phenoxy]propylazanium Traditional Name: 3-[4-(4-butyrylpiperazino)phenoxy]propylammonium Formula: C17H28N3O2+ MolecularWeight: 306.42312

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)N1CCN(CC1)C2=CC=C(C=C2)OCCC[NH3+]

Isomeric SMILES

CCCC(=O)N1CCN(CC1)C2=CC=C(C=C2)OCCC[NH3+]

InChI

InChI=1S/C17H27N3O2/c1-2-4-17(21)20-12-10-19(11-13-20)15-5-7-16(8-6-15)22-14-3-9-18/h5-8H,2-4,9-14,18H2,1H3/p+1