3-[(4-bromanyl-2,6-dimethyl-phenyl)amino]azepan-2-one

Systemtic Name: 3-[(4-bromanyl-2,6-dimethyl-phenyl)amino]azepan-2-one Openeye Name: 3-(4-bromo-2,6-dimethyl-anilino)azepan-2-one CAS Name: 3-(4-bromo-2,6-dimethylanilino)-2-azepanone IUPAC Name: 3-(4-bromo-2,6-dimethylanilino)azepan-2-one Traditional Name: 3-(4-bromo-2,6-dimethyl-anilino)azepan-2-one Formula: C14H19BrN2O MolecularWeight: 311.21746

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1NC2CCCCNC2=O)C)Br

Isomeric SMILES

CC1=CC(=CC(=C1NC2CCCCNC2=O)C)Br

InChI

InChI=1S/C14H19BrN2O/c1-9-7-11(15)8-10(2)13(9)17-12-5-3-4-6-16-14(12)18/h7-8,12,17H,3-6H2,1-2H3,(H,16,18)