[4-[(2R)-3-[(4-bromophenyl)amino]-2-oxidanyl-propoxy]phenyl]-phenyl-methanone

Systemtic Name: [4-[(2R)-3-[(4-bromophenyl)amino]-2-oxidanyl-propoxy]phenyl]-phenyl-methanone Openeye Name: [4-[(2R)-3-(4-bromoanilino)-2-hydroxy-propoxy]phenyl]-phenyl-methanone CAS Name: [4-[(2R)-3-(4-bromoanilino)-2-hydroxypropoxy]phenyl]-phenylmethanone IUPAC Name: [4-[(2R)-3-(4-bromoanilino)-2-hydroxypropoxy]phenyl]-phenylmethanone Traditional Name: [4-[(2R)-3-(4-bromoanilino)-2-hydroxy-propoxy]phenyl]-phenyl-methanone Formula: C22H20BrNO3 MolecularWeight: 426.3031

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)C2=CC=C(C=C2)OCC(CNC3=CC=C(C=C3)Br)O

Isomeric SMILES

C1=CC=C(C=C1)C(=O)C2=CC=C(C=C2)OC[C@@H](CNC3=CC=C(C=C3)Br)O

InChI

InChI=1S/C22H20BrNO3/c23-18-8-10-19(11-9-18)24-14-20(25)15-27-21-12-6-17(7-13-21)22(26)16-4-2-1-3-5-16/h1-13,20,24-25H,14-15H2/t20-/m1/s1