2-nitro-N-[2-(phenylmethyl)sulfonylethyl]aniline

Systemtic Name: 2-nitro-N-[2-(phenylmethyl)sulfonylethyl]aniline Openeye Name: N-(2-benzylsulfonylethyl)-2-nitro-aniline CAS Name: 2-nitro-N-[2-(phenylmethyl)sulfonylethyl]aniline IUPAC Name: N-(2-benzylsulfonylethyl)-2-nitroaniline Traditional Name: 2-benzylsulfonylethyl-(2-nitrophenyl)amine Formula: C15H16N2O4S MolecularWeight: 320.36354

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CS(=O)(=O)CCNC2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CS(=O)(=O)CCNC2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C15H16N2O4S/c18-17(19)15-9-5-4-8-14(15)16-10-11-22(20,21)12-13-6-2-1-3-7-13/h1-9,16H,10-12H2