N-methyl-N-[2-(4-methylphenoxy)ethyl]-4-methylsulfanyl-3-nitro-benzamide

Systemtic Name: N-methyl-N-[2-(4-methylphenoxy)ethyl]-4-methylsulfanyl-3-nitro-benzamide Openeye Name: N-methyl-N-[2-(4-methylphenoxy)ethyl]-4-methylsulfanyl-3-nitro-benzamide CAS Name: N-methyl-N-[2-(4-methylphenoxy)ethyl]-4-(methylthio)-3-nitrobenzamide IUPAC Name: N-methyl-N-[2-(4-methylphenoxy)ethyl]-4-methylsulfanyl-3-nitrobenzamide Traditional Name: N-methyl-N-[2-(4-methylphenoxy)ethyl]-4-(methylthio)-3-nitro-benzamide Formula: C18H20N2O4S MolecularWeight: 360.4274

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OCCN(C)C(=O)C2=CC(=C(C=C2)SC)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)OCCN(C)C(=O)C2=CC(=C(C=C2)SC)[N+](=O)[O-]

InChI

InChI=1S/C18H20N2O4S/c1-13-4-7-15(8-5-13)24-11-10-19(2)18(21)14-6-9-17(25-3)16(12-14)20(22)23/h4-9,12H,10-11H2,1-3H3