(3S)-1-(4-methoxy-2,5-dimethyl-phenyl)sulfonylpiperidine-3-carbaldehyde

Systemtic Name: (3S)-1-(4-methoxy-2,5-dimethyl-phenyl)sulfonylpiperidine-3-carbaldehyde Openeye Name: (3S)-1-(4-methoxy-2,5-dimethyl-phenyl)sulfonylpiperidine-3-carbaldehyde CAS Name: (3S)-1-(4-methoxy-2,5-dimethylphenyl)sulfonyl-3-piperidinecarboxaldehyde IUPAC Name: (3S)-1-(4-methoxy-2,5-dimethylphenyl)sulfonylpiperidine-3-carbaldehyde Traditional Name: (3S)-1-(4-methoxy-2,5-dimethyl-phenyl)sulfonylnipecotaldehyde Formula: C15H21NO4S MolecularWeight: 311.39654

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1S(=O)(=O)N2CCCC(C2)C=O)C)OC

Isomeric SMILES

CC1=CC(=C(C=C1S(=O)(=O)N2CCC[C@@H](C2)C=O)C)OC

InChI

InChI=1S/C15H21NO4S/c1-11-8-15(12(2)7-14(11)20-3)21(18,19)16-6-4-5-13(9-16)10-17/h7-8,10,13H,4-6,9H2,1-3H3/t13-/m0/s1