(E)-4-(2-bromophenyl)-3-[[(phenylmethyl)amino]methyl]but-3-en-2-one

Systemtic Name: (E)-4-(2-bromophenyl)-3-[[(phenylmethyl)amino]methyl]but-3-en-2-one Openeye Name: (E)-3-[(benzylamino)methyl]-4-(2-bromophenyl)but-3-en-2-one CAS Name: (E)-4-(2-bromophenyl)-3-[[(phenylmethyl)amino]methyl]-3-buten-2-one IUPAC Name: (E)-3-[(benzylamino)methyl]-4-(2-bromophenyl)but-3-en-2-one Traditional Name: (E)-3-[(benzylamino)methyl]-4-(2-bromophenyl)but-3-en-2-one Formula: C18H18BrNO MolecularWeight: 344.24562

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(=CC1=CC=CC=C1Br)CNCC2=CC=CC=C2

Isomeric SMILES

CC(=O)/C(=C/C1=CC=CC=C1Br)/CNCC2=CC=CC=C2

InChI

InChI=1S/C18H18BrNO/c1-14(21)17(11-16-9-5-6-10-18(16)19)13-20-12-15-7-3-2-4-8-15/h2-11,20H,12-13H2,1H3/b17-11+