(4-nitrophenyl) 2-(4-piperidin-1-ylsulfonylphenyl)ethanoate

Systemtic Name: (4-nitrophenyl) 2-(4-piperidin-1-ylsulfonylphenyl)ethanoate Openeye Name: (4-nitrophenyl) 2-[4-(1-piperidylsulfonyl)phenyl]acetate CAS Name: 2-[4-(1-piperidinylsulfonyl)phenyl]acetic acid (4-nitrophenyl) ester IUPAC Name: (4-nitrophenyl) 2-(4-piperidin-1-ylsulfonylphenyl)acetate Traditional Name: 2-(4-piperidinosulfonylphenyl)acetic acid (4-nitrophenyl) ester Formula: C19H20N2O6S MolecularWeight: 404.4369

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)CC(=O)OC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)CC(=O)OC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H20N2O6S/c22-19(27-17-8-6-16(7-9-17)21(23)24)14-15-4-10-18(11-5-15)28(25,26)20-12-2-1-3-13-20/h4-11H,1-3,12-14H2