3-methyl-N-[1-(4-methylsulfonylphenyl)ethyl]-2-nitro-benzamide

Systemtic Name: 3-methyl-N-[1-(4-methylsulfonylphenyl)ethyl]-2-nitro-benzamide Openeye Name: 3-methyl-N-[1-(4-methylsulfonylphenyl)ethyl]-2-nitro-benzamide CAS Name: 3-methyl-N-[1-(4-methylsulfonylphenyl)ethyl]-2-nitrobenzamide IUPAC Name: 3-methyl-N-[1-(4-methylsulfonylphenyl)ethyl]-2-nitrobenzamide Traditional Name: N-[1-(4-mesylphenyl)ethyl]-3-methyl-2-nitro-benzamide Formula: C17H18N2O5S MolecularWeight: 362.40022

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H18N2O5S/c1-11-5-4-6-15(16(11)19(21)22)17(20)18-12(2)13-7-9-14(10-8-13)25(3,23)24/h4-10,12H,1-3H3,(H,18,20)