1-(4-methoxy-3-methyl-phenyl)sulfonylpiperidine-4-carboxylate

Systemtic Name: 1-(4-methoxy-3-methyl-phenyl)sulfonylpiperidine-4-carboxylate Openeye Name: 1-(4-methoxy-3-methyl-phenyl)sulfonylpiperidine-4-carboxylate CAS Name: 1-(4-methoxy-3-methylphenyl)sulfonyl-4-piperidinecarboxylate IUPAC Name: 1-(4-methoxy-3-methylphenyl)sulfonylpiperidine-4-carboxylate Traditional Name: 1-(4-methoxy-3-methyl-phenyl)sulfonylisonipecotate Formula: C14H18NO5S- MolecularWeight: 312.36142

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)S(=O)(=O)N2CCC(CC2)C(=O)[O-])OC

Isomeric SMILES

CC1=C(C=CC(=C1)S(=O)(=O)N2CCC(CC2)C(=O)[O-])OC

InChI

InChI=1S/C14H19NO5S/c1-10-9-12(3-4-13(10)20-2)21(18,19)15-7-5-11(6-8-15)14(16)17/h3-4,9,11H,5-8H2,1-2H3,(H,16,17)/p-1