[4-[2-[[(2R)-butan-2-yl]amino]-2-oxidanylidene-ethoxy]-3-ethoxy-phenyl]methylazanium

Systemtic Name: [4-[2-[[(2R)-butan-2-yl]amino]-2-oxidanylidene-ethoxy]-3-ethoxy-phenyl]methylazanium Openeye Name: [3-ethoxy-4-[2-[[(1R)-1-methylpropyl]amino]-2-oxo-ethoxy]phenyl]methylammonium CAS Name: [4-[2-[[(2R)-butan-2-yl]amino]-2-oxoethoxy]-3-ethoxyphenyl]methylammonium IUPAC Name: [4-[2-[[(2R)-butan-2-yl]amino]-2-oxoethoxy]-3-ethoxyphenyl]methylazanium Traditional Name: [3-ethoxy-4-[2-keto-2-[[(1R)-1-methylpropyl]amino]ethoxy]benzyl]ammonium Formula: C15H25N2O3+ MolecularWeight: 281.3706

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)COC1=C(C=C(C=C1)C[NH3+])OCC

Isomeric SMILES

CC[C@@H](C)NC(=O)COC1=C(C=C(C=C1)C[NH3+])OCC

InChI

InChI=1S/C15H24N2O3/c1-4-11(3)17-15(18)10-20-13-7-6-12(9-16)8-14(13)19-5-2/h6-8,11H,4-5,9-10,16H2,1-3H3,(H,17,18)/p+1/t11-/m1/s1