2-bromanyl-6-[[3-[(2-chloranyl-4-nitro-phenyl)amino]propylamino]methylidene]-4-methyl-cyclohexa-2,4-dien-1-one

Systemtic Name: 2-bromanyl-6-[[3-[(2-chloranyl-4-nitro-phenyl)amino]propylamino]methylidene]-4-methyl-cyclohexa-2,4-dien-1-one Openeye Name: 2-bromo-6-[[3-(2-chloro-4-nitro-anilino)propylamino]methylene]-4-methyl-cyclohexa-2,4-dien-1-one CAS Name: 2-bromo-6-[[3-(2-chloro-4-nitroanilino)propylamino]methylidene]-4-methyl-1-cyclohexa-2,4-dienone IUPAC Name: 2-bromo-6-[[3-(2-chloro-4-nitroanilino)propylamino]methylidene]-4-methylcyclohexa-2,4-dien-1-one Traditional Name: 2-bromo-6-[[3-(2-chloro-4-nitro-anilino)propylamino]methylene]-4-methyl-cyclohexa-2,4-dien-1-one Formula: C17H17BrClN3O3 MolecularWeight: 426.69218

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CNCCCNC2=C(C=C(C=C2)[N+](=O)[O-])Cl)C(=O)C(=C1)Br

Isomeric SMILES

CC1=CC(=CNCCCNC2=C(C=C(C=C2)[N+](=O)[O-])Cl)C(=O)C(=C1)Br

InChI

InChI=1S/C17H17BrClN3O3/c1-11-7-12(17(23)14(18)8-11)10-20-5-2-6-21-16-4-3-13(22(24)25)9-15(16)19/h3-4,7-10,20-21H,2,5-6H2,1H3