7-bromanyl-N-(2,5-dimethylphenyl)-1-benzoxepine-4-carboxamide

Systemtic Name: 7-bromanyl-N-(2,5-dimethylphenyl)-1-benzoxepine-4-carboxamide Openeye Name: 7-bromo-N-(2,5-dimethylphenyl)-1-benzoxepine-4-carboxamide CAS Name: 7-bromo-N-(2,5-dimethylphenyl)-1-benzoxepin-4-carboxamide IUPAC Name: 7-bromo-N-(2,5-dimethylphenyl)-1-benzoxepine-4-carboxamide Traditional Name: 7-bromo-N-(2,5-dimethylphenyl)-1-benzoxepin-4-carboxamide Formula: C19H16BrNO2 MolecularWeight: 370.23984

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)NC(=O)C2=CC3=C(C=CC(=C3)Br)OC=C2

Isomeric SMILES

CC1=CC(=C(C=C1)C)NC(=O)C2=CC3=C(C=CC(=C3)Br)OC=C2

InChI

InChI=1S/C19H16BrNO2/c1-12-3-4-13(2)17(9-12)21-19(22)14-7-8-23-18-6-5-16(20)11-15(18)10-14/h3-11H,1-2H3,(H,21,22)