4-methyl-1-(3-nitro-4-piperidin-1-yl-phenyl)sulfonyl-piperidine

Systemtic Name: 4-methyl-1-(3-nitro-4-piperidin-1-yl-phenyl)sulfonyl-piperidine Openeye Name: 4-methyl-1-[3-nitro-4-(1-piperidyl)phenyl]sulfonyl-piperidine CAS Name: 4-methyl-1-[3-nitro-4-(1-piperidinyl)phenyl]sulfonylpiperidine IUPAC Name: 4-methyl-1-(3-nitro-4-piperidin-1-ylphenyl)sulfonylpiperidine Traditional Name: 4-methyl-1-(3-nitro-4-piperidino-phenyl)sulfonyl-piperidine Formula: C17H25N3O4S MolecularWeight: 367.4631

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)N3CCCCC3)[N+](=O)[O-]

Isomeric SMILES

CC1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)N3CCCCC3)[N+](=O)[O-]

InChI

InChI=1S/C17H25N3O4S/c1-14-7-11-19(12-8-14)25(23,24)15-5-6-16(17(13-15)20(21)22)18-9-3-2-4-10-18/h5-6,13-14H,2-4,7-12H2,1H3