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

Systemtic Name: 3-(3,5-dimethylphenoxy)propyl-[2-(ethoxycarbonylamino)-2-oxidanylidene-ethyl]-ethyl-azanium Openeye Name: 3-(3,5-dimethylphenoxy)propyl-[2-(ethoxycarbonylamino)-2-oxo-ethyl]-ethyl-ammonium CAS Name: 3-(3,5-dimethylphenoxy)propyl-[2-(ethoxycarbonylamino)-2-oxoethyl]-ethylammonium IUPAC Name: 3-(3,5-dimethylphenoxy)propyl-[2-(ethoxycarbonylamino)-2-oxoethyl]-ethylazanium Traditional Name: [2-(carbethoxyamino)-2-keto-ethyl]-[3-(3,5-dimethylphenoxy)propyl]-ethyl-ammonium Formula: C18H29N2O4+ MolecularWeight: 337.43386

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CCCOC1=CC(=CC(=C1)C)C)CC(=O)NC(=O)OCC

Isomeric SMILES

CC[NH+](CCCOC1=CC(=CC(=C1)C)C)CC(=O)NC(=O)OCC

InChI

InChI=1S/C18H28N2O4/c1-5-20(13-17(21)19-18(22)23-6-2)8-7-9-24-16-11-14(3)10-15(4)12-16/h10-12H,5-9,13H2,1-4H3,(H,19,21,22)/p+1