2-chloranyl-5-[5-methyl-3-oxidanylidene-4-[(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)methyl]-1H-pyrazol-2-yl]benzoic acid

Systemtic Name: 2-chloranyl-5-[5-methyl-3-oxidanylidene-4-[(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)methyl]-1H-pyrazol-2-yl]benzoic acid Openeye Name: 2-chloro-5-[5-methyl-3-oxo-4-[(6-oxocyclohexa-2,4-dien-1-ylidene)methyl]-1H-pyrazol-2-yl]benzoic acid CAS Name: 2-chloro-5-[5-methyl-3-oxo-4-[(6-oxo-1-cyclohexa-2,4-dienylidene)methyl]-1H-pyrazol-2-yl]benzoic acid IUPAC Name: 2-chloro-5-[5-methyl-3-oxo-4-[(6-oxocyclohexa-2,4-dien-1-ylidene)methyl]-1H-pyrazol-2-yl]benzoic acid Traditional Name: 2-chloro-5-[5-keto-4-[(6-ketocyclohexa-2,4-dien-1-ylidene)methyl]-3-methyl-3-pyrazolin-1-yl]benzoic acid Formula: C18H13ClN2O4 MolecularWeight: 356.75982

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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=CC3=O

Isomeric SMILES

CC1=C(C(=O)N(N1)C2=CC(=C(C=C2)Cl)C(=O)O)C=C3C=CC=CC3=O

InChI

InChI=1S/C18H13ClN2O4/c1-10-13(8-11-4-2-3-5-16(11)22)17(23)21(20-10)12-6-7-15(19)14(9-12)18(24)25/h2-9,20H,1H3,(H,24,25)