4-(2-chlorophenyl)sulfanyl-N-(3-methoxypropyl)-3-nitro-benzamide

Systemtic Name: 4-(2-chlorophenyl)sulfanyl-N-(3-methoxypropyl)-3-nitro-benzamide Openeye Name: 4-(2-chlorophenyl)sulfanyl-N-(3-methoxypropyl)-3-nitro-benzamide CAS Name: 4-[(2-chlorophenyl)thio]-N-(3-methoxypropyl)-3-nitrobenzamide IUPAC Name: 4-(2-chlorophenyl)sulfanyl-N-(3-methoxypropyl)-3-nitrobenzamide Traditional Name: 4-[(2-chlorophenyl)thio]-N-(3-methoxypropyl)-3-nitro-benzamide Formula: C17H17ClN2O4S MolecularWeight: 380.84588

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Descriptors Computed from Structure

Canonical SMILES:

COCCCNC(=O)C1=CC(=C(C=C1)SC2=CC=CC=C2Cl)[N+](=O)[O-]

Isomeric SMILES

COCCCNC(=O)C1=CC(=C(C=C1)SC2=CC=CC=C2Cl)[N+](=O)[O-]

InChI

InChI=1S/C17H17ClN2O4S/c1-24-10-4-9-19-17(21)12-7-8-16(14(11-12)20(22)23)25-15-6-3-2-5-13(15)18/h2-3,5-8,11H,4,9-10H2,1H3,(H,19,21)