2-[[[4-(4-ethoxyphenyl)-4-oxidanylidene-butanoyl]amino]methyl]-4-nitro-phenolate

Systemtic Name: 2-[[[4-(4-ethoxyphenyl)-4-oxidanylidene-butanoyl]amino]methyl]-4-nitro-phenolate Openeye Name: 2-[[[4-(4-ethoxyphenyl)-4-oxo-butanoyl]amino]methyl]-4-nitro-phenolate CAS Name: 2-[[[4-(4-ethoxyphenyl)-1,4-dioxobutyl]amino]methyl]-4-nitrophenolate IUPAC Name: 2-[[[4-(4-ethoxyphenyl)-4-oxobutanoyl]amino]methyl]-4-nitrophenolate Traditional Name: 2-[[(4-keto-4-p-phenetyl-butanoyl)amino]methyl]-4-nitro-phenolate Formula: C19H19N2O6- MolecularWeight: 371.36396

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C(=O)CCC(=O)NCC2=C(C=CC(=C2)[N+](=O)[O-])[O-]

Isomeric SMILES

CCOC1=CC=C(C=C1)C(=O)CCC(=O)NCC2=C(C=CC(=C2)[N+](=O)[O-])[O-]

InChI

InChI=1S/C19H20N2O6/c1-2-27-16-6-3-13(4-7-16)17(22)9-10-19(24)20-12-14-11-15(21(25)26)5-8-18(14)23/h3-8,11,23H,2,9-10,12H2,1H3,(H,20,24)/p-1