(Z)-2-diazonio-1-ethoxy-5-(1-methyl-3,4-dihydro-1H-isoquinolin-2-yl)-3-oxidanylidene-pent-1-en-1-olate

Systemtic Name: (Z)-2-diazonio-1-ethoxy-5-(1-methyl-3,4-dihydro-1H-isoquinolin-2-yl)-3-oxidanylidene-pent-1-en-1-olate Openeye Name: (Z)-2-diazonio-1-ethoxy-5-(1-methyl-3,4-dihydro-1H-isoquinolin-2-yl)-3-oxo-pent-1-en-1-olate CAS Name: (Z)-2-diazonio-1-ethoxy-5-(1-methyl-3,4-dihydro-1H-isoquinolin-2-yl)-3-oxo-1-penten-1-olate IUPAC Name: (Z)-2-diazonio-1-ethoxy-5-(1-methyl-3,4-dihydro-1H-isoquinolin-2-yl)-3-oxopent-1-en-1-olate Traditional Name: (Z)-2-diazonio-1-ethoxy-3-keto-5-(1-methyl-3,4-dihydro-1H-isoquinolin-2-yl)pent-1-en-1-olate Formula: C17H21N3O3 MolecularWeight: 315.36694

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=C(C(=O)CCN1CCC2=CC=CC=C2C1C)[N+]#N)[O-]

Isomeric SMILES

CCO/C(=C(/C(=O)CCN1CCC2=CC=CC=C2C1C)\[N+]#N)/[O-]

InChI

InChI=1S/C17H21N3O3/c1-3-23-17(22)16(19-18)15(21)9-11-20-10-8-13-6-4-5-7-14(13)12(20)2/h4-7,12H,3,8-11H2,1-2H3