N-(3-cyclopentylsulfonylphenyl)-4-methyl-3-nitro-benzamide

Systemtic Name: N-(3-cyclopentylsulfonylphenyl)-4-methyl-3-nitro-benzamide Openeye Name: N-(3-cyclopentylsulfonylphenyl)-4-methyl-3-nitro-benzamide CAS Name: N-(3-cyclopentylsulfonylphenyl)-4-methyl-3-nitrobenzamide IUPAC Name: N-(3-cyclopentylsulfonylphenyl)-4-methyl-3-nitrobenzamide Traditional Name: N-(3-cyclopentylsulfonylphenyl)-4-methyl-3-nitro-benzamide Formula: C19H20N2O5S MolecularWeight: 388.4375

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC2=CC(=CC=C2)S(=O)(=O)C3CCCC3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC2=CC(=CC=C2)S(=O)(=O)C3CCCC3)[N+](=O)[O-]

InChI

InChI=1S/C19H20N2O5S/c1-13-9-10-14(11-18(13)21(23)24)19(22)20-15-5-4-8-17(12-15)27(25,26)16-6-2-3-7-16/h4-5,8-12,16H,2-3,6-7H2,1H3,(H,20,22)