(Z)-1-[2-[[but-3-enyl(prop-2-enyl)amino]methyl]phenoxy]-2-diazonio-3-oxidanylidene-but-1-en-1-olate

Systemtic Name: (Z)-1-[2-[[but-3-enyl(prop-2-enyl)amino]methyl]phenoxy]-2-diazonio-3-oxidanylidene-but-1-en-1-olate Openeye Name: (Z)-1-[2-[[allyl(but-3-enyl)amino]methyl]phenoxy]-2-diazonio-3-oxo-but-1-en-1-olate CAS Name: (Z)-1-[2-[[but-3-enyl(prop-2-enyl)amino]methyl]phenoxy]-2-diazonio-3-oxo-1-buten-1-olate IUPAC Name: (Z)-1-[2-[[but-3-enyl(prop-2-enyl)amino]methyl]phenoxy]-2-diazonio-3-oxobut-1-en-1-olate Traditional Name: (Z)-1-[2-[[allyl(but-3-enyl)amino]methyl]phenoxy]-2-diazonio-3-keto-but-1-en-1-olate Formula: C18H21N3O3 MolecularWeight: 327.37764

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(=C([O-])OC1=CC=CC=C1CN(CCC=C)CC=C)[N+]#N

Isomeric SMILES

CC(=O)/C(=C(\[O-])/OC1=CC=CC=C1CN(CCC=C)CC=C)/[N+]#N

InChI

InChI=1S/C18H21N3O3/c1-4-6-12-21(11-5-2)13-15-9-7-8-10-16(15)24-18(23)17(20-19)14(3)22/h4-5,7-10H,1-2,6,11-13H2,3H3