(E)-1-(2-oxidanyl-5-oxidanylidene-cyclopenten-1-yl)propylidene-phenethyl-azanium

Systemtic Name: (E)-1-(2-oxidanyl-5-oxidanylidene-cyclopenten-1-yl)propylidene-phenethyl-azanium Openeye Name: (E)-1-(2-hydroxy-5-oxo-cyclopenten-1-yl)propylidene-phenethyl-ammonium CAS Name: (E)-1-(2-hydroxy-5-oxo-1-cyclopentenyl)propylidene-phenethylammonium IUPAC Name: (E)-1-(2-hydroxy-5-oxocyclopenten-1-yl)propylidene-phenethylazanium Traditional Name: (E)-1-(2-hydroxy-5-keto-cyclopenten-1-yl)propylidene-phenethyl-ammonium Formula: C16H20NO2+ MolecularWeight: 258.3355

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=[NH+]CCC1=CC=CC=C1)C2=C(CCC2=O)O

Isomeric SMILES

CC/C(=[NH+]\CCC1=CC=CC=C1)/C2=C(CCC2=O)O

InChI

InChI=1S/C16H19NO2/c1-2-13(16-14(18)8-9-15(16)19)17-11-10-12-6-4-3-5-7-12/h3-7,18H,2,8-11H2,1H3/p+1/b17-13+