N-[3-(2-nitro-4-piperidin-1-ylsulfonyl-phenoxy)phenyl]ethanamide

Systemtic Name: N-[3-(2-nitro-4-piperidin-1-ylsulfonyl-phenoxy)phenyl]ethanamide Openeye Name: N-[3-[2-nitro-4-(1-piperidylsulfonyl)phenoxy]phenyl]acetamide CAS Name: N-[3-[2-nitro-4-(1-piperidinylsulfonyl)phenoxy]phenyl]acetamide IUPAC Name: N-[3-(2-nitro-4-piperidin-1-ylsulfonylphenoxy)phenyl]acetamide Traditional Name: N-[3-(2-nitro-4-piperidinosulfonyl-phenoxy)phenyl]acetamide Formula: C19H21N3O6S MolecularWeight: 419.45154

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC(=CC=C1)OC2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)[N+](=O)[O-]

Isomeric SMILES

CC(=O)NC1=CC(=CC=C1)OC2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)[N+](=O)[O-]

InChI

InChI=1S/C19H21N3O6S/c1-14(23)20-15-6-5-7-16(12-15)28-19-9-8-17(13-18(19)22(24)25)29(26,27)21-10-3-2-4-11-21/h5-9,12-13H,2-4,10-11H2,1H3,(H,20,23)