N-[(1R,2S)-2-methylcyclohexyl]-4-[(4-methyl-3-nitro-phenyl)sulfonylamino]benzamide

Systemtic Name: N-[(1R,2S)-2-methylcyclohexyl]-4-[(4-methyl-3-nitro-phenyl)sulfonylamino]benzamide Openeye Name: N-[(1R,2S)-2-methylcyclohexyl]-4-[(4-methyl-3-nitro-phenyl)sulfonylamino]benzamide CAS Name: N-[(1R,2S)-2-methylcyclohexyl]-4-[(4-methyl-3-nitrophenyl)sulfonylamino]benzamide IUPAC Name: N-[(1R,2S)-2-methylcyclohexyl]-4-[(4-methyl-3-nitrophenyl)sulfonylamino]benzamide Traditional Name: N-[(1R,2S)-2-methylcyclohexyl]-4-[(4-methyl-3-nitro-phenyl)sulfonylamino]benzamide Formula: C21H25N3O5S MolecularWeight: 431.5053

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCC1NC(=O)C2=CC=C(C=C2)NS(=O)(=O)C3=CC(=C(C=C3)C)[N+](=O)[O-]

Isomeric SMILES

C[C@H]1CCCC[C@H]1NC(=O)C2=CC=C(C=C2)NS(=O)(=O)C3=CC(=C(C=C3)C)[N+](=O)[O-]

InChI

InChI=1S/C21H25N3O5S/c1-14-5-3-4-6-19(14)22-21(25)16-8-10-17(11-9-16)23-30(28,29)18-12-7-15(2)20(13-18)24(26)27/h7-14,19,23H,3-6H2,1-2H3,(H,22,25)/t14-,19+/m0/s1