(3S)-1-[(2,6-dimethylphenyl)carbamoyl]piperidine-3-carboxylate

Systemtic Name: (3S)-1-[(2,6-dimethylphenyl)carbamoyl]piperidine-3-carboxylate Openeye Name: (3S)-1-[(2,6-dimethylphenyl)carbamoyl]piperidine-3-carboxylate CAS Name: (3S)-1-[(2,6-dimethylanilino)-oxomethyl]-3-piperidinecarboxylate IUPAC Name: (3S)-1-[(2,6-dimethylphenyl)carbamoyl]piperidine-3-carboxylate Traditional Name: (3S)-1-[(2,6-dimethylphenyl)carbamoyl]nipecotate Formula: C15H19N2O3- MolecularWeight: 275.32296

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC(=O)N2CCCC(C2)C(=O)[O-]

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC(=O)N2CCC[C@@H](C2)C(=O)[O-]

InChI

InChI=1S/C15H20N2O3/c1-10-5-3-6-11(2)13(10)16-15(20)17-8-4-7-12(9-17)14(18)19/h3,5-6,12H,4,7-9H2,1-2H3,(H,16,20)(H,18,19)/p-1/t12-/m0/s1