(3S)-1-(3-methyl-2-oxidanyl-phenyl)carbonylpiperidine-3-carboxylate

Systemtic Name: (3S)-1-(3-methyl-2-oxidanyl-phenyl)carbonylpiperidine-3-carboxylate Openeye Name: (3S)-1-(2-hydroxy-3-methyl-benzoyl)piperidine-3-carboxylate CAS Name: (3S)-1-[(2-hydroxy-3-methylphenyl)-oxomethyl]-3-piperidinecarboxylate IUPAC Name: (3S)-1-(2-hydroxy-3-methylbenzoyl)piperidine-3-carboxylate Traditional Name: (3S)-1-(2-hydroxy-3-methyl-benzoyl)nipecotate Formula: C14H16NO4- MolecularWeight: 262.28114

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1O)C(=O)N2CCCC(C2)C(=O)[O-]

Isomeric SMILES

CC1=CC=CC(=C1O)C(=O)N2CCC[C@@H](C2)C(=O)[O-]

InChI

InChI=1S/C14H17NO4/c1-9-4-2-6-11(12(9)16)13(17)15-7-3-5-10(8-15)14(18)19/h2,4,6,10,16H,3,5,7-8H2,1H3,(H,18,19)/p-1/t10-/m0/s1