2-(5-methoxy-2-nitro-4-phenylmethoxy-phenyl)ethyl methanesulfonate

Systemtic Name: 2-(5-methoxy-2-nitro-4-phenylmethoxy-phenyl)ethyl methanesulfonate Openeye Name: 2-(4-benzyloxy-5-methoxy-2-nitro-phenyl)ethyl methanesulfonate CAS Name: methanesulfonic acid 2-(5-methoxy-2-nitro-4-phenylmethoxyphenyl)ethyl ester IUPAC Name: 2-(5-methoxy-2-nitro-4-phenylmethoxyphenyl)ethyl methanesulfonate Traditional Name: methanesulfonic acid 2-(4-benzoxy-5-methoxy-2-nitro-phenyl)ethyl ester Formula: C17H19NO7S MolecularWeight: 381.40026

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)CCOS(=O)(=O)C)[N+](=O)[O-])OCC2=CC=CC=C2

Isomeric SMILES

COC1=C(C=C(C(=C1)CCOS(=O)(=O)C)[N+](=O)[O-])OCC2=CC=CC=C2

InChI

InChI=1S/C17H19NO7S/c1-23-16-10-14(8-9-25-26(2,21)22)15(18(19)20)11-17(16)24-12-13-6-4-3-5-7-13/h3-7,10-11H,8-9,12H2,1-2H3