(E)-1-[3-indol-1-ylpropanoyl(methyl)amino]-1-oxidanyl-3-oxidanylidene-but-1-ene-2-diazonium

Systemtic Name: (E)-1-[3-indol-1-ylpropanoyl(methyl)amino]-1-oxidanyl-3-oxidanylidene-but-1-ene-2-diazonium Openeye Name: (E)-1-hydroxy-1-[3-indol-1-ylpropanoyl(methyl)amino]-3-oxo-but-1-ene-2-diazonium CAS Name: (E)-1-hydroxy-1-[[3-(1-indolyl)-1-oxopropyl]-methylamino]-3-oxo-1-butene-2-diazonium IUPAC Name: (E)-1-hydroxy-1-[3-indol-1-ylpropanoyl(methyl)amino]-3-oxobut-1-ene-2-diazonium Traditional Name: (E)-1-hydroxy-1-[3-indol-1-ylpropanoyl(methyl)amino]-3-keto-but-1-ene-2-diazonium Formula: C16H17N4O3+ MolecularWeight: 313.33118

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(=C(N(C)C(=O)CCN1C=CC2=CC=CC=C21)O)[N+]#N

Isomeric SMILES

CC(=O)/C(=C(/N(C)C(=O)CCN1C=CC2=CC=CC=C21)\O)/[N+]#N

InChI

InChI=1S/C16H16N4O3/c1-11(21)15(18-17)16(23)19(2)14(22)8-10-20-9-7-12-5-3-4-6-13(12)20/h3-7,9H,8,10H2,1-2H3/p+1