2-[(Z)-3-(2,4-dichlorophenyl)-3-oxidanylidene-2-(1,2,4-triazol-1-yl)prop-1-enyl]-4-nitro-phenolate

Systemtic Name: 2-[(Z)-3-(2,4-dichlorophenyl)-3-oxidanylidene-2-(1,2,4-triazol-1-yl)prop-1-enyl]-4-nitro-phenolate Openeye Name: 2-[(Z)-3-(2,4-dichlorophenyl)-3-oxo-2-(1,2,4-triazol-1-yl)prop-1-enyl]-4-nitro-phenolate CAS Name: 2-[(Z)-3-(2,4-dichlorophenyl)-3-oxo-2-(1,2,4-triazol-1-yl)prop-1-enyl]-4-nitrophenolate IUPAC Name: 2-[(Z)-3-(2,4-dichlorophenyl)-3-oxo-2-(1,2,4-triazol-1-yl)prop-1-enyl]-4-nitrophenolate Traditional Name: 2-[(Z)-3-(2,4-dichlorophenyl)-3-keto-2-(1,2,4-triazol-1-yl)prop-1-enyl]-4-nitro-phenolate Formula: C17H9Cl2N4O4- MolecularWeight: 404.18376

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1[N+](=O)[O-])C=C(C(=O)C2=C(C=C(C=C2)Cl)Cl)N3C=NC=N3)[O-]

Isomeric SMILES

C1=CC(=C(C=C1[N+](=O)[O-])/C=C(/C(=O)C2=C(C=C(C=C2)Cl)Cl)\N3C=NC=N3)[O-]

InChI

InChI=1S/C17H10Cl2N4O4/c18-11-1-3-13(14(19)7-11)17(25)15(22-9-20-8-21-22)6-10-5-12(23(26)27)2-4-16(10)24/h1-9,24H/p-1/b15-6-