2-[(3-bromanyl-5-chloranyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methylamino]-4-tert-butyl-phenolate

Systemtic Name: 2-[(3-bromanyl-5-chloranyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methylamino]-4-tert-butyl-phenolate Openeye Name: 2-[(3-bromo-5-chloro-6-oxo-cyclohexa-2,4-dien-1-ylidene)methylamino]-4-tert-butyl-phenolate CAS Name: 2-[(3-bromo-5-chloro-6-oxo-1-cyclohexa-2,4-dienylidene)methylamino]-4-tert-butylphenolate IUPAC Name: 2-[(3-bromo-5-chloro-6-oxocyclohexa-2,4-dien-1-ylidene)methylamino]-4-tert-butylphenolate Traditional Name: 2-[(3-bromo-5-chloro-6-keto-cyclohexa-2,4-dien-1-ylidene)methylamino]-4-tert-butyl-phenolate Formula: C17H16BrClNO2- MolecularWeight: 381.67144

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C(C=C1)[O-])NC=C2C=C(C=C(C2=O)Cl)Br

Isomeric SMILES

CC(C)(C)C1=CC(=C(C=C1)[O-])NC=C2C=C(C=C(C2=O)Cl)Br

InChI

InChI=1S/C17H17BrClNO2/c1-17(2,3)11-4-5-15(21)14(7-11)20-9-10-6-12(18)8-13(19)16(10)22/h4-9,20-21H,1-3H3/p-1