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

Systemtic Name: 3-[4-(4-butanoylpiperazin-1-yl)phenyl]propylazanium Openeye Name: 3-[4-(4-butanoylpiperazin-1-yl)phenyl]propylammonium CAS Name: 3-[4-[4-(1-oxobutyl)-1-piperazinyl]phenyl]propylammonium IUPAC Name: 3-[4-(4-butanoylpiperazin-1-yl)phenyl]propylazanium Traditional Name: 3-[4-(4-butyrylpiperazino)phenyl]propylammonium Formula: C17H28N3O+ MolecularWeight: 290.42372

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H27N3O/c1-2-4-17(21)20-13-11-19(12-14-20)16-8-6-15(7-9-16)5-3-10-18/h6-9H,2-5,10-14,18H2,1H3/p+1