4-[(E)-3-[(5-bromanyl-2-fluoranyl-phenyl)methylamino]-3-oxidanylidene-prop-1-enyl]-N-methyl-benzamide

Systemtic Name: 4-[(E)-3-[(5-bromanyl-2-fluoranyl-phenyl)methylamino]-3-oxidanylidene-prop-1-enyl]-N-methyl-benzamide Openeye Name: 4-[(E)-3-[(5-bromo-2-fluoro-phenyl)methylamino]-3-oxo-prop-1-enyl]-N-methyl-benzamide CAS Name: 4-[(E)-3-[(5-bromo-2-fluorophenyl)methylamino]-3-oxoprop-1-enyl]-N-methylbenzamide IUPAC Name: 4-[(E)-3-[(5-bromo-2-fluorophenyl)methylamino]-3-oxoprop-1-enyl]-N-methylbenzamide Traditional Name: 4-[(E)-3-[(5-bromo-2-fluoro-benzyl)amino]-3-keto-prop-1-enyl]-N-methyl-benzamide Formula: C18H16BrFN2O2 MolecularWeight: 391.234243

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1=CC=C(C=C1)C=CC(=O)NCC2=C(C=CC(=C2)Br)F

Isomeric SMILES

CNC(=O)C1=CC=C(C=C1)/C=C/C(=O)NCC2=C(C=CC(=C2)Br)F

InChI

InChI=1S/C18H16BrFN2O2/c1-21-18(24)13-5-2-12(3-6-13)4-9-17(23)22-11-14-10-15(19)7-8-16(14)20/h2-10H,11H2,1H3,(H,21,24)(H,22,23)/b9-4+