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

Systemtic Name: N-[2-[(4-methylsulfonyl-2-nitro-phenyl)amino]ethyl]-2-naphthalen-2-yl-ethanamide Openeye Name: N-[2-(4-methylsulfonyl-2-nitro-anilino)ethyl]-2-(2-naphthyl)acetamide CAS Name: N-[2-(4-methylsulfonyl-2-nitroanilino)ethyl]-2-(2-naphthalenyl)acetamide IUPAC Name: N-[2-(4-methylsulfonyl-2-nitroanilino)ethyl]-2-naphthalen-2-ylacetamide Traditional Name: N-[2-(4-mesyl-2-nitro-anilino)ethyl]-2-(2-naphthyl)acetamide Formula: C21H21N3O5S MolecularWeight: 427.47354

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC(=C(C=C1)NCCNC(=O)CC2=CC3=CC=CC=C3C=C2)[N+](=O)[O-]

Isomeric SMILES

CS(=O)(=O)C1=CC(=C(C=C1)NCCNC(=O)CC2=CC3=CC=CC=C3C=C2)[N+](=O)[O-]

InChI

InChI=1S/C21H21N3O5S/c1-30(28,29)18-8-9-19(20(14-18)24(26)27)22-10-11-23-21(25)13-15-6-7-16-4-2-3-5-17(16)12-15/h2-9,12,14,22H,10-11,13H2,1H3,(H,23,25)