propyl 5-nitro-2-(phenylsulfanylmethoxy)benzoate

Systemtic Name: propyl 5-nitro-2-(phenylsulfanylmethoxy)benzoate Openeye Name: propyl 5-nitro-2-(phenylsulfanylmethoxy)benzoate CAS Name: 5-nitro-2-[(phenylthio)methoxy]benzoic acid propyl ester IUPAC Name: propyl 5-nitro-2-(phenylsulfanylmethoxy)benzoate Traditional Name: 5-nitro-2-[(phenylthio)methoxy]benzoic acid propyl ester Formula: C17H17NO5S MolecularWeight: 347.38558

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=C(C=CC(=C1)[N+](=O)[O-])OCSC2=CC=CC=C2

Isomeric SMILES

CCCOC(=O)C1=C(C=CC(=C1)[N+](=O)[O-])OCSC2=CC=CC=C2

InChI

InChI=1S/C17H17NO5S/c1-2-10-22-17(19)15-11-13(18(20)21)8-9-16(15)23-12-24-14-6-4-3-5-7-14/h3-9,11H,2,10,12H2,1H3