2-[2-(4-cyano-2-ethoxy-phenoxy)ethanoylamino]ethyl-di(propan-2-yl)azanium

Systemtic Name: 2-[2-(4-cyano-2-ethoxy-phenoxy)ethanoylamino]ethyl-di(propan-2-yl)azanium Openeye Name: 2-[[2-(4-cyano-2-ethoxy-phenoxy)acetyl]amino]ethyl-diisopropyl-ammonium CAS Name: 2-[[2-(4-cyano-2-ethoxyphenoxy)-1-oxoethyl]amino]ethyl-di(propan-2-yl)ammonium IUPAC Name: 2-[[2-(4-cyano-2-ethoxyphenoxy)acetyl]amino]ethyl-di(propan-2-yl)azanium Traditional Name: 2-[[2-(4-cyano-2-ethoxy-phenoxy)acetyl]amino]ethyl-diisopropyl-ammonium Formula: C19H30N3O3+ MolecularWeight: 348.4598

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C#N)OCC(=O)NCC[NH+](C(C)C)C(C)C

Isomeric SMILES

CCOC1=C(C=CC(=C1)C#N)OCC(=O)NCC[NH+](C(C)C)C(C)C

InChI

InChI=1S/C19H29N3O3/c1-6-24-18-11-16(12-20)7-8-17(18)25-13-19(23)21-9-10-22(14(2)3)15(4)5/h7-8,11,14-15H,6,9-10,13H2,1-5H3,(H,21,23)/p+1