4-[(3-chloranyl-2,4-dimethyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methylamino]-2-oxidanyl-benzoate

Systemtic Name: 4-[(3-chloranyl-2,4-dimethyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methylamino]-2-oxidanyl-benzoate Openeye Name: 4-[(3-chloro-2,4-dimethyl-6-oxo-cyclohexa-2,4-dien-1-ylidene)methylamino]-2-hydroxy-benzoate CAS Name: 4-[(3-chloro-2,4-dimethyl-6-oxo-1-cyclohexa-2,4-dienylidene)methylamino]-2-hydroxybenzoate IUPAC Name: 4-[(3-chloro-2,4-dimethyl-6-oxocyclohexa-2,4-dien-1-ylidene)methylamino]-2-hydroxybenzoate Traditional Name: 4-[(3-chloro-6-keto-2,4-dimethyl-cyclohexa-2,4-dien-1-ylidene)methylamino]-2-hydroxy-benzoate Formula: C16H13ClNO4- MolecularWeight: 318.73172

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)C(=CNC2=CC(=C(C=C2)C(=O)[O-])O)C(=C1Cl)C

Isomeric SMILES

CC1=CC(=O)C(=CNC2=CC(=C(C=C2)C(=O)[O-])O)C(=C1Cl)C

InChI

InChI=1S/C16H14ClNO4/c1-8-5-13(19)12(9(2)15(8)17)7-18-10-3-4-11(16(21)22)14(20)6-10/h3-7,18,20H,1-2H3,(H,21,22)/p-1