(E)-4-(2-bromophenyl)-3-(phenylazanylmethyl)but-3-en-2-one

Systemtic Name: (E)-4-(2-bromophenyl)-3-(phenylazanylmethyl)but-3-en-2-one Openeye Name: (E)-3-(anilinomethyl)-4-(2-bromophenyl)but-3-en-2-one CAS Name: (E)-3-(anilinomethyl)-4-(2-bromophenyl)-3-buten-2-one IUPAC Name: (E)-3-(anilinomethyl)-4-(2-bromophenyl)but-3-en-2-one Traditional Name: (E)-3-(anilinomethyl)-4-(2-bromophenyl)but-3-en-2-one Formula: C17H16BrNO MolecularWeight: 330.21904

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(=CC1=CC=CC=C1Br)CNC2=CC=CC=C2

Isomeric SMILES

CC(=O)/C(=C/C1=CC=CC=C1Br)/CNC2=CC=CC=C2

InChI

InChI=1S/C17H16BrNO/c1-13(20)15(11-14-7-5-6-10-17(14)18)12-19-16-8-3-2-4-9-16/h2-11,19H,12H2,1H3/b15-11+