ethyl 2-[4-[(2-nitrophenyl)methylsulfonyl]piperazin-1-yl]ethanoate

Systemtic Name: ethyl 2-[4-[(2-nitrophenyl)methylsulfonyl]piperazin-1-yl]ethanoate Openeye Name: ethyl 2-[4-[(2-nitrophenyl)methylsulfonyl]piperazin-1-yl]acetate CAS Name: 2-[4-[(2-nitrophenyl)methylsulfonyl]-1-piperazinyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[4-[(2-nitrophenyl)methylsulfonyl]piperazin-1-yl]acetate Traditional Name: 2-[4-(2-nitrobenzyl)sulfonylpiperazino]acetic acid ethyl ester Formula: C15H21N3O6S MolecularWeight: 371.40874

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1CCN(CC1)S(=O)(=O)CC2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)CN1CCN(CC1)S(=O)(=O)CC2=CC=CC=C2[N+](=O)[O-]

InChI

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