carbamimidoyl-[4-[[(2-methylpropan-2-yl)oxycarbonylamino]methyl]phenyl]azanium hydrochloride

Systemtic Name: carbamimidoyl-[4-[[(2-methylpropan-2-yl)oxycarbonylamino]methyl]phenyl]azanium hydrochloride Openeye Name: [4-[(tert-butoxycarbonylamino)methyl]phenyl]-carbamimidoyl-ammonium hydrochloride CAS Name: carbamimidoyl-[4-[[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]methyl]phenyl]ammonium hydrochloride IUPAC Name: carbamimidoyl-[4-[[(2-methylpropan-2-yl)oxycarbonylamino]methyl]phenyl]azanium hydrochloride Traditional Name: amidino-[4-[(tert-butoxycarbonylamino)methyl]phenyl]ammonium hydrochloride Formula: C13H22ClN4O2+ MolecularWeight: 301.79238

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCC1=CC=C(C=C1)[NH2+]C(=N)N.Cl

Isomeric SMILES

CC(C)(C)OC(=O)NCC1=CC=C(C=C1)[NH2+]C(=N)N.Cl

InChI

InChI=1S/C13H20N4O2.ClH/c1-13(2,3)19-12(18)16-8-9-4-6-10(7-5-9)17-11(14)15;/h4-7H,8H2,1-3H3,(H,16,18)(H4,14,15,17);1H/p+1