N-(2-methylcyclohexyl)-4-methylsulfonyl-2-nitro-aniline

Systemtic Name: N-(2-methylcyclohexyl)-4-methylsulfonyl-2-nitro-aniline Openeye Name: N-(2-methylcyclohexyl)-4-methylsulfonyl-2-nitro-aniline CAS Name: N-(2-methylcyclohexyl)-4-methylsulfonyl-2-nitroaniline IUPAC Name: N-(2-methylcyclohexyl)-4-methylsulfonyl-2-nitroaniline Traditional Name: (4-mesyl-2-nitro-phenyl)-(2-methylcyclohexyl)amine Formula: C14H20N2O4S MolecularWeight: 312.3846

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCC1NC2=C(C=C(C=C2)S(=O)(=O)C)[N+](=O)[O-]

Isomeric SMILES

CC1CCCCC1NC2=C(C=C(C=C2)S(=O)(=O)C)[N+](=O)[O-]

InChI

InChI=1S/C14H20N2O4S/c1-10-5-3-4-6-12(10)15-13-8-7-11(21(2,19)20)9-14(13)16(17)18/h7-10,12,15H,3-6H2,1-2H3