N-(4-cyclopentyloxyphenyl)-2-[(2-methyl-5-nitro-phenyl)-methylsulfonyl-amino]ethanamide

Systemtic Name: N-(4-cyclopentyloxyphenyl)-2-[(2-methyl-5-nitro-phenyl)-methylsulfonyl-amino]ethanamide Openeye Name: N-[4-(cyclopentoxy)phenyl]-2-(2-methyl-N-methylsulfonyl-5-nitro-anilino)acetamide CAS Name: N-(4-cyclopentyloxyphenyl)-2-(2-methyl-N-methylsulfonyl-5-nitroanilino)acetamide IUPAC Name: N-(4-cyclopentyloxyphenyl)-2-(2-methyl-N-methylsulfonyl-5-nitroanilino)acetamide Traditional Name: N-[4-(cyclopentoxy)phenyl]-2-(N-mesyl-2-methyl-5-nitro-anilino)acetamide Formula: C21H25N3O6S MolecularWeight: 447.5047

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])N(CC(=O)NC2=CC=C(C=C2)OC3CCCC3)S(=O)(=O)C

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])N(CC(=O)NC2=CC=C(C=C2)OC3CCCC3)S(=O)(=O)C

InChI

InChI=1S/C21H25N3O6S/c1-15-7-10-17(24(26)27)13-20(15)23(31(2,28)29)14-21(25)22-16-8-11-19(12-9-16)30-18-5-3-4-6-18/h7-13,18H,3-6,14H2,1-2H3,(H,22,25)