(6E)-6-[[(4-bromanyl-2,6-dimethyl-phenyl)amino]methylidene]-3-nitro-cyclohexa-2,4-dien-1-one

Systemtic Name: (6E)-6-[[(4-bromanyl-2,6-dimethyl-phenyl)amino]methylidene]-3-nitro-cyclohexa-2,4-dien-1-one Openeye Name: (6E)-6-[(4-bromo-2,6-dimethyl-anilino)methylene]-3-nitro-cyclohexa-2,4-dien-1-one CAS Name: (6E)-6-[(4-bromo-2,6-dimethylanilino)methylidene]-3-nitro-1-cyclohexa-2,4-dienone IUPAC Name: (6E)-6-[(4-bromo-2,6-dimethylanilino)methylidene]-3-nitrocyclohexa-2,4-dien-1-one Traditional Name: (6E)-6-[(4-bromo-2,6-dimethyl-anilino)methylene]-3-nitro-cyclohexa-2,4-dien-1-one Formula: C15H13BrN2O3 MolecularWeight: 349.17932

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1NC=C2C=CC(=CC2=O)[N+](=O)[O-])C)Br

Isomeric SMILES

CC1=CC(=CC(=C1N/C=C/2\C=CC(=CC2=O)[N+](=O)[O-])C)Br

InChI

InChI=1S/C15H13BrN2O3/c1-9-5-12(16)6-10(2)15(9)17-8-11-3-4-13(18(20)21)7-14(11)19/h3-8,17H,1-2H3/b11-8+