[2-(ethoxycarbonylamino)-2-oxidanylidene-ethyl]-ethyl-[3-(3-methylphenoxy)propyl]azanium

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H26N2O4/c1-4-19(13-16(20)18-17(21)22-5-2)10-7-11-23-15-9-6-8-14(3)12-15/h6,8-9,12H,4-5,7,10-11,13H2,1-3H3,(H,18,20,21)/p+1