4-chloranyl-3-nitro-N-(3-phenylsulfanylpropyl)benzamide

Systemtic Name: 4-chloranyl-3-nitro-N-(3-phenylsulfanylpropyl)benzamide Openeye Name: 4-chloro-3-nitro-N-(3-phenylsulfanylpropyl)benzamide CAS Name: 4-chloro-3-nitro-N-[3-(phenylthio)propyl]benzamide IUPAC Name: 4-chloro-3-nitro-N-(3-phenylsulfanylpropyl)benzamide Traditional Name: 4-chloro-3-nitro-N-[3-(phenylthio)propyl]benzamide Formula: C16H15ClN2O3S MolecularWeight: 350.8199

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SCCCNC(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)SCCCNC(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C16H15ClN2O3S/c17-14-8-7-12(11-15(14)19(21)22)16(20)18-9-4-10-23-13-5-2-1-3-6-13/h1-3,5-8,11H,4,9-10H2,(H,18,20)