2-(3,5-dimethylphenoxy)ethyl-[2-(ethoxycarbonylamino)-2-oxidanylidene-ethyl]-ethyl-azanium

Systemtic Name: 2-(3,5-dimethylphenoxy)ethyl-[2-(ethoxycarbonylamino)-2-oxidanylidene-ethyl]-ethyl-azanium Openeye Name: 2-(3,5-dimethylphenoxy)ethyl-[2-(ethoxycarbonylamino)-2-oxo-ethyl]-ethyl-ammonium CAS Name: 2-(3,5-dimethylphenoxy)ethyl-[2-(ethoxycarbonylamino)-2-oxoethyl]-ethylammonium IUPAC Name: 2-(3,5-dimethylphenoxy)ethyl-[2-(ethoxycarbonylamino)-2-oxoethyl]-ethylazanium Traditional Name: [2-(carbethoxyamino)-2-keto-ethyl]-[2-(3,5-dimethylphenoxy)ethyl]-ethyl-ammonium Formula: C17H27N2O4+ MolecularWeight: 323.40728

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CCOC1=CC(=CC(=C1)C)C)CC(=O)NC(=O)OCC

Isomeric SMILES

CC[NH+](CCOC1=CC(=CC(=C1)C)C)CC(=O)NC(=O)OCC

InChI

InChI=1S/C17H26N2O4/c1-5-19(12-16(20)18-17(21)22-6-2)7-8-23-15-10-13(3)9-14(4)11-15/h9-11H,5-8,12H2,1-4H3,(H,18,20,21)/p+1