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

Systemtic Name: N-[2-(4-methoxyphenyl)ethyl]-4-methylsulfanyl-3-nitro-benzamide Openeye Name: N-[2-(4-methoxyphenyl)ethyl]-4-methylsulfanyl-3-nitro-benzamide CAS Name: N-[2-(4-methoxyphenyl)ethyl]-4-(methylthio)-3-nitrobenzamide IUPAC Name: N-[2-(4-methoxyphenyl)ethyl]-4-methylsulfanyl-3-nitrobenzamide Traditional Name: N-[2-(4-methoxyphenyl)ethyl]-4-(methylthio)-3-nitro-benzamide Formula: C17H18N2O4S MolecularWeight: 346.40082

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CCNC(=O)C2=CC(=C(C=C2)SC)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)CCNC(=O)C2=CC(=C(C=C2)SC)[N+](=O)[O-]

InChI

InChI=1S/C17H18N2O4S/c1-23-14-6-3-12(4-7-14)9-10-18-17(20)13-5-8-16(24-2)15(11-13)19(21)22/h3-8,11H,9-10H2,1-2H3,(H,18,20)