2-chloranyl-5-[5-methyl-3-oxidanylidene-4-[(Z)-pyrrol-2-ylidenemethyl]-1H-pyrazol-2-yl]benzoic acid

Systemtic Name: 2-chloranyl-5-[5-methyl-3-oxidanylidene-4-[(Z)-pyrrol-2-ylidenemethyl]-1H-pyrazol-2-yl]benzoic acid Openeye Name: 2-chloro-5-[5-methyl-3-oxo-4-[(Z)-pyrrol-2-ylidenemethyl]-1H-pyrazol-2-yl]benzoic acid CAS Name: 2-chloro-5-[5-methyl-3-oxo-4-[(Z)-2-pyrrolylidenemethyl]-1H-pyrazol-2-yl]benzoic acid IUPAC Name: 2-chloro-5-[5-methyl-3-oxo-4-[(Z)-pyrrol-2-ylidenemethyl]-1H-pyrazol-2-yl]benzoic acid Traditional Name: 2-chloro-5-[5-keto-3-methyl-4-[(Z)-pyrrol-2-ylidenemethyl]-3-pyrazolin-1-yl]benzoic acid Formula: C16H12ClN3O3 MolecularWeight: 329.73778

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1)C2=CC(=C(C=C2)Cl)C(=O)O)C=C3C=CC=N3

Isomeric SMILES

CC1=C(C(=O)N(N1)C2=CC(=C(C=C2)Cl)C(=O)O)/C=C\3/C=CC=N3

InChI

InChI=1S/C16H12ClN3O3/c1-9-12(7-10-3-2-6-18-10)15(21)20(19-9)11-4-5-14(17)13(8-11)16(22)23/h2-8,19H,1H3,(H,22,23)/b10-7-