(Z)-4-[2-(4-hydroxyphenyl)ethyl]-1-methoxy-1-oxidanyl-3-oxidanylidene-hept-1-ene-2-diazonium

Systemtic Name: (Z)-4-[2-(4-hydroxyphenyl)ethyl]-1-methoxy-1-oxidanyl-3-oxidanylidene-hept-1-ene-2-diazonium Openeye Name: (Z)-1-hydroxy-4-[2-(4-hydroxyphenyl)ethyl]-1-methoxy-3-oxo-hept-1-ene-2-diazonium CAS Name: (Z)-1-hydroxy-4-[2-(4-hydroxyphenyl)ethyl]-1-methoxy-3-oxo-1-heptene-2-diazonium IUPAC Name: (Z)-1-hydroxy-4-[2-(4-hydroxyphenyl)ethyl]-1-methoxy-3-oxohept-1-ene-2-diazonium Traditional Name: (Z)-1-hydroxy-4-[2-(4-hydroxyphenyl)ethyl]-3-keto-1-methoxy-hept-1-ene-2-diazonium Formula: C16H21N2O4+ MolecularWeight: 305.34894

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CCC1=CC=C(C=C1)O)C(=O)C(=C(O)OC)[N+]#N

Isomeric SMILES

CCCC(CCC1=CC=C(C=C1)O)C(=O)/C(=C(\O)/OC)/[N+]#N

InChI

InChI=1S/C16H20N2O4/c1-3-4-12(15(20)14(18-17)16(21)22-2)8-5-11-6-9-13(19)10-7-11/h6-7,9-10,12H,3-5,8H2,1-2H3,(H-,19,20,21)/p+1