1-bromanyl-2-[(1R)-1-methoxy-2-[(R)-(4-methylphenyl)sulfinyl]ethyl]-4-nitro-benzene

Systemtic Name: 1-bromanyl-2-[(1R)-1-methoxy-2-[(R)-(4-methylphenyl)sulfinyl]ethyl]-4-nitro-benzene Openeye Name: 1-bromo-2-[(1R)-1-methoxy-2-[(R)-p-tolylsulfinyl]ethyl]-4-nitro-benzene CAS Name: 1-bromo-2-[(1R)-1-methoxy-2-[(R)-(4-methylphenyl)sulfinyl]ethyl]-4-nitrobenzene IUPAC Name: 1-bromo-2-[(1R)-1-methoxy-2-[(R)-(4-methylphenyl)sulfinyl]ethyl]-4-nitrobenzene Traditional Name: 1-bromo-2-[(1R)-1-methoxy-2-[(R)-p-tolylsulfinyl]ethyl]-4-nitro-benzene Formula: C16H16BrNO4S MolecularWeight: 398.27154

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)CC(C2=C(C=CC(=C2)[N+](=O)[O-])Br)OC

Isomeric SMILES

CC1=CC=C(C=C1)[S@](=O)C[C@@H](C2=C(C=CC(=C2)[N+](=O)[O-])Br)OC

InChI

InChI=1S/C16H16BrNO4S/c1-11-3-6-13(7-4-11)23(21)10-16(22-2)14-9-12(18(19)20)5-8-15(14)17/h3-9,16H,10H2,1-2H3/t16-,23+/m0/s1