N-[2-[(4-methylsulfonyl-2-nitro-phenyl)amino]ethyl]-2-(phenoxymethyl)benzamide

Systemtic Name: N-[2-[(4-methylsulfonyl-2-nitro-phenyl)amino]ethyl]-2-(phenoxymethyl)benzamide Openeye Name: N-[2-(4-methylsulfonyl-2-nitro-anilino)ethyl]-2-(phenoxymethyl)benzamide CAS Name: N-[2-(4-methylsulfonyl-2-nitroanilino)ethyl]-2-(phenoxymethyl)benzamide IUPAC Name: N-[2-(4-methylsulfonyl-2-nitroanilino)ethyl]-2-(phenoxymethyl)benzamide Traditional Name: N-[2-(4-mesyl-2-nitro-anilino)ethyl]-2-(phenoxymethyl)benzamide Formula: C23H23N3O6S MolecularWeight: 469.51022

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC(=C(C=C1)NCCNC(=O)C2=CC=CC=C2COC3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CS(=O)(=O)C1=CC(=C(C=C1)NCCNC(=O)C2=CC=CC=C2COC3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C23H23N3O6S/c1-33(30,31)19-11-12-21(22(15-19)26(28)29)24-13-14-25-23(27)20-10-6-5-7-17(20)16-32-18-8-3-2-4-9-18/h2-12,15,24H,13-14,16H2,1H3,(H,25,27)