(Z)-1-ethoxy-3-[3-(2-ethynylphenyl)propanoyl-methyl-amino]-1-oxidanyl-3-oxidanylidene-prop-1-ene-2-diazonium

Systemtic Name: (Z)-1-ethoxy-3-[3-(2-ethynylphenyl)propanoyl-methyl-amino]-1-oxidanyl-3-oxidanylidene-prop-1-ene-2-diazonium Openeye Name: (Z)-1-ethoxy-3-[3-(2-ethynylphenyl)propanoyl-methyl-amino]-1-hydroxy-3-oxo-prop-1-ene-2-diazonium CAS Name: (Z)-1-ethoxy-3-[[3-(2-ethynylphenyl)-1-oxopropyl]-methylamino]-1-hydroxy-3-oxo-1-propene-2-diazonium IUPAC Name: (Z)-1-ethoxy-3-[3-(2-ethynylphenyl)propanoyl-methylamino]-1-hydroxy-3-oxoprop-1-ene-2-diazonium Traditional Name: (Z)-1-ethoxy-3-[3-(2-ethynylphenyl)propanoyl-methyl-amino]-1-hydroxy-3-keto-prop-1-ene-2-diazonium Formula: C17H18N3O4+ MolecularWeight: 328.34252

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=C(C(=O)N(C)C(=O)CCC1=CC=CC=C1C#C)[N+]#N)O

Isomeric SMILES

CCO/C(=C(/C(=O)N(C)C(=O)CCC1=CC=CC=C1C#C)\[N+]#N)/O

InChI

InChI=1S/C17H17N3O4/c1-4-12-8-6-7-9-13(12)10-11-14(21)20(3)16(22)15(19-18)17(23)24-5-2/h1,6-9H,5,10-11H2,2-3H3/p+1