4-bromanyl-N-[(E)-[1-(2,6-dimethylphenyl)-2,5-dimethyl-pyrrol-3-yl]methylideneamino]benzamide

Systemtic Name: 4-bromanyl-N-[(E)-[1-(2,6-dimethylphenyl)-2,5-dimethyl-pyrrol-3-yl]methylideneamino]benzamide Openeye Name: 4-bromo-N-[(E)-[1-(2,6-dimethylphenyl)-2,5-dimethyl-pyrrol-3-yl]methyleneamino]benzamide CAS Name: 4-bromo-N-[(E)-[1-(2,6-dimethylphenyl)-2,5-dimethyl-3-pyrrolyl]methylideneamino]benzamide IUPAC Name: 4-bromo-N-[(E)-[1-(2,6-dimethylphenyl)-2,5-dimethylpyrrol-3-yl]methylideneamino]benzamide Traditional Name: 4-bromo-N-[(E)-[1-(2,6-dimethylphenyl)-2,5-dimethyl-pyrrol-3-yl]methyleneamino]benzamide Formula: C22H22BrN3O MolecularWeight: 424.33358

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)N2C(=CC(=C2C)C=NNC(=O)C3=CC=C(C=C3)Br)C

Isomeric SMILES

CC1=C(C(=CC=C1)C)N2C(=CC(=C2C)/C=N/NC(=O)C3=CC=C(C=C3)Br)C

InChI

InChI=1S/C22H22BrN3O/c1-14-6-5-7-15(2)21(14)26-16(3)12-19(17(26)4)13-24-25-22(27)18-8-10-20(23)11-9-18/h5-13H,1-4H3,(H,25,27)/b24-13+