4-[(5-bromanyl-3-chloranyl-2,4-dimethyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methylamino]benzoate

Systemtic Name: 4-[(5-bromanyl-3-chloranyl-2,4-dimethyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methylamino]benzoate Openeye Name: 4-[(5-bromo-3-chloro-2,4-dimethyl-6-oxo-cyclohexa-2,4-dien-1-ylidene)methylamino]benzoate CAS Name: 4-[(5-bromo-3-chloro-2,4-dimethyl-6-oxo-1-cyclohexa-2,4-dienylidene)methylamino]benzoate IUPAC Name: 4-[(5-bromo-3-chloro-2,4-dimethyl-6-oxocyclohexa-2,4-dien-1-ylidene)methylamino]benzoate Traditional Name: 4-[(5-bromo-3-chloro-6-keto-2,4-dimethyl-cyclohexa-2,4-dien-1-ylidene)methylamino]benzoate Formula: C16H12BrClNO3- MolecularWeight: 381.62838

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C(=O)C1=CNC2=CC=C(C=C2)C(=O)[O-])Br)C)Cl

Isomeric SMILES

CC1=C(C(=C(C(=O)C1=CNC2=CC=C(C=C2)C(=O)[O-])Br)C)Cl

InChI

InChI=1S/C16H13BrClNO3/c1-8-12(15(20)13(17)9(2)14(8)18)7-19-11-5-3-10(4-6-11)16(21)22/h3-7,19H,1-2H3,(H,21,22)/p-1