(3S)-1-[2-oxidanylidene-2-[(4-propan-2-ylphenyl)amino]ethyl]piperidine-3-carboxylic acid

Systemtic Name: (3S)-1-[2-oxidanylidene-2-[(4-propan-2-ylphenyl)amino]ethyl]piperidine-3-carboxylic acid Openeye Name: (3S)-1-[2-(4-isopropylanilino)-2-oxo-ethyl]piperidine-3-carboxylic acid CAS Name: (3S)-1-[2-oxo-2-(4-propan-2-ylanilino)ethyl]-3-piperidinecarboxylic acid IUPAC Name: (3S)-1-[2-oxo-2-(4-propan-2-ylanilino)ethyl]piperidine-3-carboxylic acid Traditional Name: (3S)-1-(2-cumidino-2-keto-ethyl)nipecotic acid Formula: C17H24N2O3 MolecularWeight: 304.38406

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)NC(=O)CN2CCCC(C2)C(=O)O

Isomeric SMILES

CC(C)C1=CC=C(C=C1)NC(=O)CN2CCC[C@@H](C2)C(=O)O

InChI

InChI=1S/C17H24N2O3/c1-12(2)13-5-7-15(8-6-13)18-16(20)11-19-9-3-4-14(10-19)17(21)22/h5-8,12,14H,3-4,9-11H2,1-2H3,(H,18,20)(H,21,22)/t14-/m0/s1