3-[4-[2-[(4-ethoxycarbonylphenyl)amino]-2-oxidanylidene-ethoxy]carbonylphenyl]-1,2,3-oxadiazol-3-ium-5-olate

Systemtic Name: 3-[4-[2-[(4-ethoxycarbonylphenyl)amino]-2-oxidanylidene-ethoxy]carbonylphenyl]-1,2,3-oxadiazol-3-ium-5-olate Openeye Name: 3-[4-[2-(4-ethoxycarbonylanilino)-2-oxo-ethoxy]carbonylphenyl]oxadiazol-3-ium-5-olate CAS Name: 3-[4-[[2-(4-ethoxycarbonylanilino)-2-oxoethoxy]-oxomethyl]phenyl]-5-oxadiazol-3-iumolate IUPAC Name: 3-[4-[2-(4-ethoxycarbonylanilino)-2-oxoethoxy]carbonylphenyl]oxadiazol-3-ium-5-olate Traditional Name: 3-[4-[2-(4-carbethoxyanilino)-2-keto-ethoxy]carbonylphenyl]oxadiazol-3-ium-5-olate Formula: C20H17N3O7 MolecularWeight: 411.36488

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)COC(=O)C2=CC=C(C=C2)[N+]3=NOC(=C3)[O-]

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)COC(=O)C2=CC=C(C=C2)[N+]3=NOC(=C3)[O-]

InChI

InChI=1S/C20H17N3O7/c1-2-28-19(26)13-3-7-15(8-4-13)21-17(24)12-29-20(27)14-5-9-16(10-6-14)23-11-18(25)30-22-23/h3-11H,2,12H2,1H3,(H-,21,22,24,25,26)