(E)-2-diazonio-1-[5-indol-1-ylpentanoyl(methyl)amino]-3-oxidanylidene-but-1-en-1-olate

Systemtic Name: (E)-2-diazonio-1-[5-indol-1-ylpentanoyl(methyl)amino]-3-oxidanylidene-but-1-en-1-olate Openeye Name: (E)-2-diazonio-1-[5-indol-1-ylpentanoyl(methyl)amino]-3-oxo-but-1-en-1-olate CAS Name: (E)-2-diazonio-1-[[5-(1-indolyl)-1-oxopentyl]-methylamino]-3-oxo-1-buten-1-olate IUPAC Name: (E)-2-diazonio-1-[5-indol-1-ylpentanoyl(methyl)amino]-3-oxobut-1-en-1-olate Traditional Name: (E)-2-diazonio-1-[5-indol-1-ylpentanoyl(methyl)amino]-3-keto-but-1-en-1-olate Formula: C18H20N4O3 MolecularWeight: 340.3764

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(=C(N(C)C(=O)CCCCN1C=CC2=CC=CC=C21)[O-])[N+]#N

Isomeric SMILES

CC(=O)/C(=C(/N(C)C(=O)CCCCN1C=CC2=CC=CC=C21)\[O-])/[N+]#N

InChI

InChI=1S/C18H20N4O3/c1-13(23)17(20-19)18(25)21(2)16(24)9-5-6-11-22-12-10-14-7-3-4-8-15(14)22/h3-4,7-8,10,12H,5-6,9,11H2,1-2H3