[3-[[(2R)-butan-2-yl]-[(2-ethoxyphenyl)methyl]amino]-3-oxidanylidene-propyl]azanium

Systemtic Name: [3-[[(2R)-butan-2-yl]-[(2-ethoxyphenyl)methyl]amino]-3-oxidanylidene-propyl]azanium Openeye Name: [3-[(2-ethoxyphenyl)methyl-[(1R)-1-methylpropyl]amino]-3-oxo-propyl]ammonium CAS Name: [3-[[(2R)-butan-2-yl]-[(2-ethoxyphenyl)methyl]amino]-3-oxopropyl]ammonium IUPAC Name: [3-[[(2R)-butan-2-yl]-[(2-ethoxyphenyl)methyl]amino]-3-oxopropyl]azanium Traditional Name: [3-[(2-ethoxybenzyl)-[(1R)-1-methylpropyl]amino]-3-keto-propyl]ammonium Formula: C16H27N2O2+ MolecularWeight: 279.39778

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N(CC1=CC=CC=C1OCC)C(=O)CC[NH3+]

Isomeric SMILES

CC[C@@H](C)N(CC1=CC=CC=C1OCC)C(=O)CC[NH3+]

InChI

InChI=1S/C16H26N2O2/c1-4-13(3)18(16(19)10-11-17)12-14-8-6-7-9-15(14)20-5-2/h6-9,13H,4-5,10-12,17H2,1-3H3/p+1/t13-/m1/s1