7-bromanyl-N-(4-methylphenyl)-1-benzoxepine-4-carboxamide

Systemtic Name: 7-bromanyl-N-(4-methylphenyl)-1-benzoxepine-4-carboxamide Openeye Name: 7-bromo-N-(p-tolyl)-1-benzoxepine-4-carboxamide CAS Name: 7-bromo-N-(4-methylphenyl)-1-benzoxepin-4-carboxamide IUPAC Name: 7-bromo-N-(4-methylphenyl)-1-benzoxepine-4-carboxamide Traditional Name: 7-bromo-N-(p-tolyl)-1-benzoxepin-4-carboxamide Formula: C18H14BrNO2 MolecularWeight: 356.21326

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H14BrNO2/c1-12-2-5-16(6-3-12)20-18(21)13-8-9-22-17-7-4-15(19)11-14(17)10-13/h2-11H,1H3,(H,20,21)