(3S)-5-(3-bromophenyl)-3-(3-nitrophenyl)-2-phenyl-3,4-dihydropyrazole

Systemtic Name: (3S)-5-(3-bromophenyl)-3-(3-nitrophenyl)-2-phenyl-3,4-dihydropyrazole Openeye Name: (3S)-5-(3-bromophenyl)-3-(3-nitrophenyl)-2-phenyl-3,4-dihydropyrazole CAS Name: (3S)-5-(3-bromophenyl)-3-(3-nitrophenyl)-2-phenyl-3,4-dihydropyrazole IUPAC Name: (3S)-5-(3-bromophenyl)-3-(3-nitrophenyl)-2-phenyl-3,4-dihydropyrazole Traditional Name: (5S)-3-(3-bromophenyl)-5-(3-nitrophenyl)-1-phenyl-2-pyrazoline Formula: C21H16BrN3O2 MolecularWeight: 422.27464

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Descriptors Computed from Structure

Canonical SMILES:

C1C(N(N=C1C2=CC(=CC=C2)Br)C3=CC=CC=C3)C4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1[C@H](N(N=C1C2=CC(=CC=C2)Br)C3=CC=CC=C3)C4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H16BrN3O2/c22-17-8-4-6-15(12-17)20-14-21(16-7-5-11-19(13-16)25(26)27)24(23-20)18-9-2-1-3-10-18/h1-13,21H,14H2/t21-/m0/s1