N-[2-[(4-methylsulfonyl-2-nitro-phenyl)amino]ethyl]-2-(4-nitrophenyl)ethanamide

Systemtic Name: N-[2-[(4-methylsulfonyl-2-nitro-phenyl)amino]ethyl]-2-(4-nitrophenyl)ethanamide Openeye Name: N-[2-(4-methylsulfonyl-2-nitro-anilino)ethyl]-2-(4-nitrophenyl)acetamide CAS Name: N-[2-(4-methylsulfonyl-2-nitroanilino)ethyl]-2-(4-nitrophenyl)acetamide IUPAC Name: N-[2-(4-methylsulfonyl-2-nitroanilino)ethyl]-2-(4-nitrophenyl)acetamide Traditional Name: N-[2-(4-mesyl-2-nitro-anilino)ethyl]-2-(4-nitrophenyl)acetamide Formula: C17H18N4O7S MolecularWeight: 422.41242

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC(=C(C=C1)NCCNC(=O)CC2=CC=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CS(=O)(=O)C1=CC(=C(C=C1)NCCNC(=O)CC2=CC=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C17H18N4O7S/c1-29(27,28)14-6-7-15(16(11-14)21(25)26)18-8-9-19-17(22)10-12-2-4-13(5-3-12)20(23)24/h2-7,11,18H,8-10H2,1H3,(H,19,22)