3-(methylsulfonylmethyl)-N-[2-[(4-nitrophenyl)amino]ethyl]benzamide

Systemtic Name: 3-(methylsulfonylmethyl)-N-[2-[(4-nitrophenyl)amino]ethyl]benzamide Openeye Name: 3-(methylsulfonylmethyl)-N-[2-(4-nitroanilino)ethyl]benzamide CAS Name: 3-(methylsulfonylmethyl)-N-[2-(4-nitroanilino)ethyl]benzamide IUPAC Name: 3-(methylsulfonylmethyl)-N-[2-(4-nitroanilino)ethyl]benzamide Traditional Name: 3-(mesylmethyl)-N-[2-(4-nitroanilino)ethyl]benzamide Formula: C17H19N3O5S MolecularWeight: 377.41486

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)CC1=CC=CC(=C1)C(=O)NCCNC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CS(=O)(=O)CC1=CC=CC(=C1)C(=O)NCCNC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C17H19N3O5S/c1-26(24,25)12-13-3-2-4-14(11-13)17(21)19-10-9-18-15-5-7-16(8-6-15)20(22)23/h2-8,11,18H,9-10,12H2,1H3,(H,19,21)