N-(3-ethoxypropyl)-3-nitro-4-phenylsulfanyl-benzamide

Systemtic Name: N-(3-ethoxypropyl)-3-nitro-4-phenylsulfanyl-benzamide Openeye Name: N-(3-ethoxypropyl)-3-nitro-4-phenylsulfanyl-benzamide CAS Name: N-(3-ethoxypropyl)-3-nitro-4-(phenylthio)benzamide IUPAC Name: N-(3-ethoxypropyl)-3-nitro-4-phenylsulfanylbenzamide Traditional Name: N-(3-ethoxypropyl)-3-nitro-4-(phenylthio)benzamide Formula: C18H20N2O4S MolecularWeight: 360.4274

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCCNC(=O)C1=CC(=C(C=C1)SC2=CC=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CCOCCCNC(=O)C1=CC(=C(C=C1)SC2=CC=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C18H20N2O4S/c1-2-24-12-6-11-19-18(21)14-9-10-17(16(13-14)20(22)23)25-15-7-4-3-5-8-15/h3-5,7-10,13H,2,6,11-12H2,1H3,(H,19,21)