3-nitro-N-[[(2R)-oxolan-2-yl]methyl]-4-phenylsulfanyl-benzamide

Systemtic Name: 3-nitro-N-[[(2R)-oxolan-2-yl]methyl]-4-phenylsulfanyl-benzamide Openeye Name: 3-nitro-4-phenylsulfanyl-N-[[(2R)-tetrahydrofuran-2-yl]methyl]benzamide CAS Name: 3-nitro-N-[[(2R)-2-oxolanyl]methyl]-4-(phenylthio)benzamide IUPAC Name: 3-nitro-N-[[(2R)-oxolan-2-yl]methyl]-4-phenylsulfanylbenzamide Traditional Name: 3-nitro-4-(phenylthio)-N-[[(2R)-tetrahydrofuran-2-yl]methyl]benzamide Formula: C18H18N2O4S MolecularWeight: 358.41152

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CNC(=O)C2=CC(=C(C=C2)SC3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C1C[C@@H](OC1)CNC(=O)C2=CC(=C(C=C2)SC3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H18N2O4S/c21-18(19-12-14-5-4-10-24-14)13-8-9-17(16(11-13)20(22)23)25-15-6-2-1-3-7-15/h1-3,6-9,11,14H,4-5,10,12H2,(H,19,21)/t14-/m1/s1