1-[(2,4,6-trimethylphenyl)carbamoyl]piperidine-3-carboxylic acid

Systemtic Name: 1-[(2,4,6-trimethylphenyl)carbamoyl]piperidine-3-carboxylic acid Openeye Name: 1-[(2,4,6-trimethylphenyl)carbamoyl]piperidine-3-carboxylic acid CAS Name: 1-[oxo-(2,4,6-trimethylanilino)methyl]-3-piperidinecarboxylic acid IUPAC Name: 1-[(2,4,6-trimethylphenyl)carbamoyl]piperidine-3-carboxylic acid Traditional Name: 1-(mesitylcarbamoyl)nipecotic acid Formula: C16H22N2O3 MolecularWeight: 290.35748

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)NC(=O)N2CCCC(C2)C(=O)O)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)NC(=O)N2CCCC(C2)C(=O)O)C

InChI

InChI=1S/C16H22N2O3/c1-10-7-11(2)14(12(3)8-10)17-16(21)18-6-4-5-13(9-18)15(19)20/h7-8,13H,4-6,9H2,1-3H3,(H,17,21)(H,19,20)