(2S)-2-[(1R,2R)-2-(4-bromophenyl)cyclopropyl]-3-methyl-N,N-diphenyl-butanamide

Systemtic Name: (2S)-2-[(1R,2R)-2-(4-bromophenyl)cyclopropyl]-3-methyl-N,N-diphenyl-butanamide Openeye Name: (2S)-2-[(1R,2R)-2-(4-bromophenyl)cyclopropyl]-3-methyl-N,N-diphenyl-butanamide CAS Name: (2S)-2-[(1R,2R)-2-(4-bromophenyl)cyclopropyl]-3-methyl-N,N-diphenylbutanamide IUPAC Name: (2S)-2-[(1R,2R)-2-(4-bromophenyl)cyclopropyl]-3-methyl-N,N-diphenylbutanamide Traditional Name: (2S)-2-[(1R,2R)-2-(4-bromophenyl)cyclopropyl]-3-methyl-N,N-diphenyl-butyramide Formula: C26H26BrNO MolecularWeight: 448.39474

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C1CC1C2=CC=C(C=C2)Br)C(=O)N(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC(C)[C@@H]([C@@H]1C[C@H]1C2=CC=C(C=C2)Br)C(=O)N(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C26H26BrNO/c1-18(2)25(24-17-23(24)19-13-15-20(27)16-14-19)26(29)28(21-9-5-3-6-10-21)22-11-7-4-8-12-22/h3-16,18,23-25H,17H2,1-2H3/t23-,24+,25-/m0/s1