3-methyl-1-[(3-nitrophenyl)methylsulfonyl]piperidine

Systemtic Name: 3-methyl-1-[(3-nitrophenyl)methylsulfonyl]piperidine Openeye Name: 3-methyl-1-[(3-nitrophenyl)methylsulfonyl]piperidine CAS Name: 3-methyl-1-[(3-nitrophenyl)methylsulfonyl]piperidine IUPAC Name: 3-methyl-1-[(3-nitrophenyl)methylsulfonyl]piperidine Traditional Name: 3-methyl-1-(3-nitrobenzyl)sulfonyl-piperidine Formula: C13H18N2O4S MolecularWeight: 298.35802

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)S(=O)(=O)CC2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CC1CCCN(C1)S(=O)(=O)CC2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C13H18N2O4S/c1-11-4-3-7-14(9-11)20(18,19)10-12-5-2-6-13(8-12)15(16)17/h2,5-6,8,11H,3-4,7,9-10H2,1H3