cyclohexa-1,3-dien-1-yl-ethoxycarbonyl-ethyl-methyl-azanium

Systemtic Name: cyclohexa-1,3-dien-1-yl-ethoxycarbonyl-ethyl-methyl-azanium Openeye Name: cyclohexa-1,3-dien-1-yl-ethoxycarbonyl-ethyl-methyl-ammonium CAS Name: 1-cyclohexa-1,3-dienyl-ethoxycarbonyl-ethyl-methylammonium IUPAC Name: cyclohexa-1,3-dien-1-yl-ethoxycarbonyl-ethyl-methylazanium Traditional Name: carbethoxy-cyclohexa-1,3-dien-1-yl-ethyl-methyl-ammonium Formula: C12H20NO2+ MolecularWeight: 210.2927

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+](C)(C1=CC=CCC1)C(=O)OCC

Isomeric SMILES

CC[N+](C)(C1=CC=CCC1)C(=O)OCC

InChI

InChI=1S/C12H20NO2/c1-4-13(3,12(14)15-5-2)11-9-7-6-8-10-11/h6-7,9H,4-5,8,10H2,1-3H3/q+1