(3S)-3-[(3-bromophenyl)amino]-1-(4-tert-butylphenyl)-3-(4-ethylphenyl)propan-1-one

Systemtic Name: (3S)-3-[(3-bromophenyl)amino]-1-(4-tert-butylphenyl)-3-(4-ethylphenyl)propan-1-one Openeye Name: (3S)-3-(3-bromoanilino)-1-(4-tert-butylphenyl)-3-(4-ethylphenyl)propan-1-one CAS Name: (3S)-3-(3-bromoanilino)-1-(4-tert-butylphenyl)-3-(4-ethylphenyl)-1-propanone IUPAC Name: (3S)-3-(3-bromoanilino)-1-(4-tert-butylphenyl)-3-(4-ethylphenyl)propan-1-one Traditional Name: (3S)-3-(3-bromoanilino)-1-(4-tert-butylphenyl)-3-(4-ethylphenyl)propan-1-one Formula: C27H30BrNO MolecularWeight: 464.4372

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(CC(=O)C2=CC=C(C=C2)C(C)(C)C)NC3=CC(=CC=C3)Br

Isomeric SMILES

CCC1=CC=C(C=C1)[C@H](CC(=O)C2=CC=C(C=C2)C(C)(C)C)NC3=CC(=CC=C3)Br

InChI

InChI=1S/C27H30BrNO/c1-5-19-9-11-20(12-10-19)25(29-24-8-6-7-23(28)17-24)18-26(30)21-13-15-22(16-14-21)27(2,3)4/h6-17,25,29H,5,18H2,1-4H3/t25-/m0/s1