(Z)-2-diazonio-1-[2-[(diphenylmethyl)-methyl-amino]ethoxy]-3-oxidanylidene-but-1-en-1-olate

Systemtic Name: (Z)-2-diazonio-1-[2-[(diphenylmethyl)-methyl-amino]ethoxy]-3-oxidanylidene-but-1-en-1-olate Openeye Name: (Z)-1-[2-[benzhydryl(methyl)amino]ethoxy]-2-diazonio-3-oxo-but-1-en-1-olate CAS Name: (Z)-2-diazonio-1-[2-[(diphenylmethyl)-methylamino]ethoxy]-3-oxo-1-buten-1-olate IUPAC Name: (Z)-1-[2-[benzhydryl(methyl)amino]ethoxy]-2-diazonio-3-oxobut-1-en-1-olate Traditional Name: (Z)-1-[2-[benzhydryl(methyl)amino]ethoxy]-2-diazonio-3-keto-but-1-en-1-olate Formula: C20H21N3O3 MolecularWeight: 351.39904

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(=C([O-])OCCN(C)C(C1=CC=CC=C1)C2=CC=CC=C2)[N+]#N

Isomeric SMILES

CC(=O)/C(=C(\[O-])/OCCN(C)C(C1=CC=CC=C1)C2=CC=CC=C2)/[N+]#N

InChI

InChI=1S/C20H21N3O3/c1-15(24)18(22-21)20(25)26-14-13-23(2)19(16-9-5-3-6-10-16)17-11-7-4-8-12-17/h3-12,19H,13-14H2,1-2H3