4-[[5-[(2S,6S)-2,6-dimethylpiperidin-1-yl]pyridin-2-yl]amino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[[5-[(2S,6S)-2,6-dimethylpiperidin-1-yl]pyridin-2-yl]amino]-4-oxidanylidene-butanoic acid Openeye Name: 4-[[5-[(2S,6S)-2,6-dimethyl-1-piperidyl]-2-pyridyl]amino]-4-oxo-butanoic acid CAS Name: 4-[[5-[(2S,6S)-2,6-dimethyl-1-piperidinyl]-2-pyridinyl]amino]-4-oxobutanoic acid IUPAC Name: 4-[[5-[(2S,6S)-2,6-dimethylpiperidin-1-yl]pyridin-2-yl]amino]-4-oxobutanoic acid Traditional Name: 4-[[5-[(2S,6S)-2,6-dimethylpiperidino]-2-pyridyl]amino]-4-keto-butyric acid Formula: C16H23N3O3 MolecularWeight: 305.37212

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(N1C2=CN=C(C=C2)NC(=O)CCC(=O)O)C

Isomeric SMILES

C[C@H]1CCC[C@@H](N1C2=CN=C(C=C2)NC(=O)CCC(=O)O)C

InChI

InChI=1S/C16H23N3O3/c1-11-4-3-5-12(2)19(11)13-6-7-14(17-10-13)18-15(20)8-9-16(21)22/h6-7,10-12H,3-5,8-9H2,1-2H3,(H,21,22)(H,17,18,20)/t11-,12-/m0/s1