2-[(1S,2R)-2-nitro-1-phenyl-propyl]sulfanylaniline

Systemtic Name: 2-[(1S,2R)-2-nitro-1-phenyl-propyl]sulfanylaniline Openeye Name: 2-[(1S,2R)-2-nitro-1-phenyl-propyl]sulfanylaniline CAS Name: 2-[[(1S,2R)-2-nitro-1-phenylpropyl]thio]aniline IUPAC Name: 2-[(1S,2R)-2-nitro-1-phenylpropyl]sulfanylaniline Traditional Name: [2-[[(1S,2R)-2-nitro-1-phenyl-propyl]thio]phenyl]amine Formula: C15H16N2O2S MolecularWeight: 288.36474

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C1=CC=CC=C1)SC2=CC=CC=C2N)[N+](=O)[O-]

Isomeric SMILES

C[C@H]([C@H](C1=CC=CC=C1)SC2=CC=CC=C2N)[N+](=O)[O-]

InChI

InChI=1S/C15H16N2O2S/c1-11(17(18)19)15(12-7-3-2-4-8-12)20-14-10-6-5-9-13(14)16/h2-11,15H,16H2,1H3/t11-,15-/m1/s1