3-[4-[4-(2-methylpropanoyl)piperazin-1-yl]phenoxy]propylazanium

Systemtic Name: 3-[4-[4-(2-methylpropanoyl)piperazin-1-yl]phenoxy]propylazanium Openeye Name: 3-[4-[4-(2-methylpropanoyl)piperazin-1-yl]phenoxy]propylammonium CAS Name: 3-[4-[4-(2-methyl-1-oxopropyl)-1-piperazinyl]phenoxy]propylammonium IUPAC Name: 3-[4-[4-(2-methylpropanoyl)piperazin-1-yl]phenoxy]propylazanium Traditional Name: 3-[4-(4-isobutyrylpiperazino)phenoxy]propylammonium Formula: C17H28N3O2+ MolecularWeight: 306.42312

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H27N3O2/c1-14(2)17(21)20-11-9-19(10-12-20)15-4-6-16(7-5-15)22-13-3-8-18/h4-7,14H,3,8-13,18H2,1-2H3/p+1