5-[[(4-bromophenyl)amino]methyl]-6-(2-imidazol-1-yl-1-phenyl-ethoxy)-3,4-dihydro-2H-naphthalen-1-one

Systemtic Name: 5-[[(4-bromophenyl)amino]methyl]-6-(2-imidazol-1-yl-1-phenyl-ethoxy)-3,4-dihydro-2H-naphthalen-1-one Openeye Name: 5-[(4-bromoanilino)methyl]-6-(2-imidazol-1-yl-1-phenyl-ethoxy)tetralin-1-one CAS Name: 5-[(4-bromoanilino)methyl]-6-[2-(1-imidazolyl)-1-phenylethoxy]-3,4-dihydro-2H-naphthalen-1-one IUPAC Name: 5-[(4-bromoanilino)methyl]-6-(2-imidazol-1-yl-1-phenylethoxy)-3,4-dihydro-2H-naphthalen-1-one Traditional Name: 5-[(4-bromoanilino)methyl]-6-(2-imidazol-1-yl-1-phenyl-ethoxy)tetralin-1-one Formula: C28H26BrN3O2 MolecularWeight: 516.42894

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C=CC(=C2CNC3=CC=C(C=C3)Br)OC(CN4C=CN=C4)C5=CC=CC=C5)C(=O)C1

Isomeric SMILES

C1CC2=C(C=CC(=C2CNC3=CC=C(C=C3)Br)OC(CN4C=CN=C4)C5=CC=CC=C5)C(=O)C1

InChI

InChI=1S/C28H26BrN3O2/c29-21-9-11-22(12-10-21)31-17-25-23-7-4-8-26(33)24(23)13-14-27(25)34-28(18-32-16-15-30-19-32)20-5-2-1-3-6-20/h1-3,5-6,9-16,19,28,31H,4,7-8,17-18H2