2-[2-[(2-methoxy-5-nitro-phenyl)-methylsulfonyl-amino]ethanoylamino]-N-phenethyl-benzamide

Systemtic Name: 2-[2-[(2-methoxy-5-nitro-phenyl)-methylsulfonyl-amino]ethanoylamino]-N-phenethyl-benzamide Openeye Name: 2-[[2-(2-methoxy-N-methylsulfonyl-5-nitro-anilino)acetyl]amino]-N-phenethyl-benzamide CAS Name: 2-[[2-(2-methoxy-N-methylsulfonyl-5-nitroanilino)-1-oxoethyl]amino]-N-phenethylbenzamide IUPAC Name: 2-[[2-(2-methoxy-N-methylsulfonyl-5-nitroanilino)acetyl]amino]-N-phenethylbenzamide Traditional Name: 2-[[2-(N-mesyl-2-methoxy-5-nitro-anilino)acetyl]amino]-N-phenethyl-benzamide Formula: C25H26N4O7S MolecularWeight: 526.56154

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)[N+](=O)[O-])N(CC(=O)NC2=CC=CC=C2C(=O)NCCC3=CC=CC=C3)S(=O)(=O)C

Isomeric SMILES

COC1=C(C=C(C=C1)[N+](=O)[O-])N(CC(=O)NC2=CC=CC=C2C(=O)NCCC3=CC=CC=C3)S(=O)(=O)C

InChI

InChI=1S/C25H26N4O7S/c1-36-23-13-12-19(29(32)33)16-22(23)28(37(2,34)35)17-24(30)27-21-11-7-6-10-20(21)25(31)26-15-14-18-8-4-3-5-9-18/h3-13,16H,14-15,17H2,1-2H3,(H,26,31)(H,27,30)