methyl-[[4-[4-[(2-methylpropan-2-yl)oxycarbonyl]piperazin-1-yl]phenyl]methyl]azanium

Systemtic Name: methyl-[[4-[4-[(2-methylpropan-2-yl)oxycarbonyl]piperazin-1-yl]phenyl]methyl]azanium Openeye Name: [4-(4-tert-butoxycarbonylpiperazin-1-yl)phenyl]methyl-methyl-ammonium CAS Name: methyl-[[4-[4-[(2-methylpropan-2-yl)oxy-oxomethyl]-1-piperazinyl]phenyl]methyl]ammonium IUPAC Name: methyl-[[4-[4-[(2-methylpropan-2-yl)oxycarbonyl]piperazin-1-yl]phenyl]methyl]azanium Traditional Name: [4-(4-tert-butoxycarbonylpiperazino)benzyl]-methyl-ammonium Formula: C17H28N3O2+ MolecularWeight: 306.42312

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(CC1)C2=CC=C(C=C2)C[NH2+]C

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(CC1)C2=CC=C(C=C2)C[NH2+]C

InChI

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