(4S)-2-(3-bromophenyl)-4-(2-chlorophenyl)-6,7-dimethoxy-4H-3,1-benzoxazine

Systemtic Name: (4S)-2-(3-bromophenyl)-4-(2-chlorophenyl)-6,7-dimethoxy-4H-3,1-benzoxazine Openeye Name: (4S)-2-(3-bromophenyl)-4-(2-chlorophenyl)-6,7-dimethoxy-4H-3,1-benzoxazine CAS Name: (4S)-2-(3-bromophenyl)-4-(2-chlorophenyl)-6,7-dimethoxy-4H-3,1-benzoxazine IUPAC Name: (4S)-2-(3-bromophenyl)-4-(2-chlorophenyl)-6,7-dimethoxy-4H-3,1-benzoxazine Traditional Name: (4S)-2-(3-bromophenyl)-4-(2-chlorophenyl)-6,7-dimethoxy-4H-3,1-benzoxazine Formula: C22H17BrClNO3 MolecularWeight: 458.73228

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(OC(=N2)C3=CC(=CC=C3)Br)C4=CC=CC=C4Cl)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)[C@H](OC(=N2)C3=CC(=CC=C3)Br)C4=CC=CC=C4Cl)OC

InChI

InChI=1S/C22H17BrClNO3/c1-26-19-11-16-18(12-20(19)27-2)25-22(13-6-5-7-14(23)10-13)28-21(16)15-8-3-4-9-17(15)24/h3-12,21H,1-2H3/t21-/m1/s1