(4R,5S)-4-bromanyl-2',3-dimethyl-1-phenyl-spiro[4H-pyrazole-5,3'-isoindole]-1'-one

Systemtic Name: (4R,5S)-4-bromanyl-2',3-dimethyl-1-phenyl-spiro[4H-pyrazole-5,3'-isoindole]-1'-one Openeye Name: (4R,5S)-4-bromo-2',3-dimethyl-1-phenyl-spiro[4H-pyrazole-5,3'-isoindoline]-1'-one CAS Name: (4R,5S)-4-bromo-2',3-dimethyl-1-phenyl-1'-spiro[4H-pyrazole-5,3'-isoindole]one IUPAC Name: (4R,5S)-4-bromo-2',3-dimethyl-1-phenylspiro[4H-pyrazole-5,3'-isoindole]-1'-one Traditional Name: (4R,5S)-4-bromo-2',3-dimethyl-1-phenyl-spiro[2-pyrazoline-5,3'-isoindoline]-1'-one Formula: C18H16BrN3O MolecularWeight: 370.24314

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2(C1Br)C3=CC=CC=C3C(=O)N2C)C4=CC=CC=C4

Isomeric SMILES

CC1=NN([C@]2([C@@H]1Br)C3=CC=CC=C3C(=O)N2C)C4=CC=CC=C4

InChI

InChI=1S/C18H16BrN3O/c1-12-16(19)18(22(20-12)13-8-4-3-5-9-13)15-11-7-6-10-14(15)17(23)21(18)2/h3-11,16H,1-2H3/t16-,18+/m1/s1