dimethyl-[[4-[[3-[(2-methylpropan-2-yl)oxycarbonylamino]propanoylamino]methyl]phenyl]methyl]azanium

Systemtic Name: dimethyl-[[4-[[3-[(2-methylpropan-2-yl)oxycarbonylamino]propanoylamino]methyl]phenyl]methyl]azanium Openeye Name: [4-[[3-(tert-butoxycarbonylamino)propanoylamino]methyl]phenyl]methyl-dimethyl-ammonium CAS Name: dimethyl-[[4-[[[3-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1-oxopropyl]amino]methyl]phenyl]methyl]ammonium IUPAC Name: dimethyl-[[4-[[3-[(2-methylpropan-2-yl)oxycarbonylamino]propanoylamino]methyl]phenyl]methyl]azanium Traditional Name: [4-[[3-(tert-butoxycarbonylamino)propanoylamino]methyl]benzyl]-dimethyl-ammonium Formula: C18H30N3O3+ MolecularWeight: 336.4491

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCCC(=O)NCC1=CC=C(C=C1)C[NH+](C)C

Isomeric SMILES

CC(C)(C)OC(=O)NCCC(=O)NCC1=CC=C(C=C1)C[NH+](C)C

InChI

InChI=1S/C18H29N3O3/c1-18(2,3)24-17(23)19-11-10-16(22)20-12-14-6-8-15(9-7-14)13-21(4)5/h6-9H,10-13H2,1-5H3,(H,19,23)(H,20,22)/p+1