methyl-[[3-[[4-[(2-methylpropan-2-yl)oxycarbonyl]piperazin-1-yl]methyl]phenyl]methyl]azanium

Systemtic Name: methyl-[[3-[[4-[(2-methylpropan-2-yl)oxycarbonyl]piperazin-1-yl]methyl]phenyl]methyl]azanium Openeye Name: [3-[(4-tert-butoxycarbonylpiperazin-1-yl)methyl]phenyl]methyl-methyl-ammonium CAS Name: methyl-[[3-[[4-[(2-methylpropan-2-yl)oxy-oxomethyl]-1-piperazinyl]methyl]phenyl]methyl]ammonium IUPAC Name: methyl-[[3-[[4-[(2-methylpropan-2-yl)oxycarbonyl]piperazin-1-yl]methyl]phenyl]methyl]azanium Traditional Name: [3-[(4-tert-butoxycarbonylpiperazino)methyl]benzyl]-methyl-ammonium Formula: C18H30N3O2+ MolecularWeight: 320.4497

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(CC1)CC2=CC(=CC=C2)C[NH2+]C

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(CC1)CC2=CC(=CC=C2)C[NH2+]C

InChI

InChI=1S/C18H29N3O2/c1-18(2,3)23-17(22)21-10-8-20(9-11-21)14-16-7-5-6-15(12-16)13-19-4/h5-7,12,19H,8-11,13-14H2,1-4H3/p+1