propan-2-yl 2-[4-(3-nitrophenyl)sulfonylpiperazin-1-yl]ethanoate

Systemtic Name: propan-2-yl 2-[4-(3-nitrophenyl)sulfonylpiperazin-1-yl]ethanoate Openeye Name: isopropyl 2-[4-(3-nitrophenyl)sulfonylpiperazin-1-yl]acetate CAS Name: 2-[4-(3-nitrophenyl)sulfonyl-1-piperazinyl]acetic acid propan-2-yl ester IUPAC Name: propan-2-yl 2-[4-(3-nitrophenyl)sulfonylpiperazin-1-yl]acetate Traditional Name: 2-[4-(3-nitrophenyl)sulfonylpiperazino]acetic acid isopropyl ester Formula: C15H21N3O6S MolecularWeight: 371.40874

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)CN1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)[N+](=O)[O-]

Isomeric SMILES

CC(C)OC(=O)CN1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)[N+](=O)[O-]

InChI

InChI=1S/C15H21N3O6S/c1-12(2)24-15(19)11-16-6-8-17(9-7-16)25(22,23)14-5-3-4-13(10-14)18(20)21/h3-5,10,12H,6-9,11H2,1-2H3