N-(2-nitro-5-propylsulfanyl-phenyl)-2-phenylmethoxy-benzamide

Systemtic Name: N-(2-nitro-5-propylsulfanyl-phenyl)-2-phenylmethoxy-benzamide Openeye Name: 2-benzyloxy-N-(2-nitro-5-propylsulfanyl-phenyl)benzamide CAS Name: N-[2-nitro-5-(propylthio)phenyl]-2-phenylmethoxybenzamide IUPAC Name: N-(2-nitro-5-propylsulfanylphenyl)-2-phenylmethoxybenzamide Traditional Name: 2-benzoxy-N-[2-nitro-5-(propylthio)phenyl]benzamide Formula: C23H22N2O4S MolecularWeight: 422.49678

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Descriptors Computed from Structure

Canonical SMILES:

CCCSC1=CC(=C(C=C1)[N+](=O)[O-])NC(=O)C2=CC=CC=C2OCC3=CC=CC=C3

Isomeric SMILES

CCCSC1=CC(=C(C=C1)[N+](=O)[O-])NC(=O)C2=CC=CC=C2OCC3=CC=CC=C3

InChI

InChI=1S/C23H22N2O4S/c1-2-14-30-18-12-13-21(25(27)28)20(15-18)24-23(26)19-10-6-7-11-22(19)29-16-17-8-4-3-5-9-17/h3-13,15H,2,14,16H2,1H3,(H,24,26)