2-chloranyl-5-[(4Z)-3-methyl-4-[(E)-3-(3-nitrophenyl)prop-2-enylidene]-5-oxidanylidene-pyrazol-1-yl]benzoate

Systemtic Name: 2-chloranyl-5-[(4Z)-3-methyl-4-[(E)-3-(3-nitrophenyl)prop-2-enylidene]-5-oxidanylidene-pyrazol-1-yl]benzoate Openeye Name: 2-chloro-5-[(4Z)-3-methyl-4-[(E)-3-(3-nitrophenyl)prop-2-enylidene]-5-oxo-pyrazol-1-yl]benzoate CAS Name: 2-chloro-5-[(4Z)-3-methyl-4-[(E)-3-(3-nitrophenyl)prop-2-enylidene]-5-oxo-1-pyrazolyl]benzoate IUPAC Name: 2-chloro-5-[(4Z)-3-methyl-4-[(E)-3-(3-nitrophenyl)prop-2-enylidene]-5-oxopyrazol-1-yl]benzoate Traditional Name: 2-chloro-5-[(4Z)-5-keto-3-methyl-4-[(E)-3-(3-nitrophenyl)prop-2-enylidene]-2-pyrazolin-1-yl]benzoate Formula: C20H13ClN3O5- MolecularWeight: 410.78732

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1=CC=CC2=CC(=CC=C2)[N+](=O)[O-])C3=CC(=C(C=C3)Cl)C(=O)[O-]

Isomeric SMILES

CC\1=NN(C(=O)/C1=C\C=C\C2=CC(=CC=C2)[N+](=O)[O-])C3=CC(=C(C=C3)Cl)C(=O)[O-]

InChI

InChI=1S/C20H14ClN3O5/c1-12-16(7-3-5-13-4-2-6-15(10-13)24(28)29)19(25)23(22-12)14-8-9-18(21)17(11-14)20(26)27/h2-11H,1H3,(H,26,27)/p-1/b5-3+,16-7-