(3S)-1-(1-ethylbenzimidazol-2-yl)piperidine-3-carboxylic acid

Systemtic Name: (3S)-1-(1-ethylbenzimidazol-2-yl)piperidine-3-carboxylic acid Openeye Name: (3S)-1-(1-ethylbenzimidazol-2-yl)piperidine-3-carboxylic acid CAS Name: (3S)-1-(1-ethyl-2-benzimidazolyl)-3-piperidinecarboxylic acid IUPAC Name: (3S)-1-(1-ethylbenzimidazol-2-yl)piperidine-3-carboxylic acid Traditional Name: (3S)-1-(1-ethylbenzimidazol-2-yl)nipecotic acid Formula: C15H19N3O2 MolecularWeight: 273.33026

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=CC=CC=C2N=C1N3CCCC(C3)C(=O)O

Isomeric SMILES

CCN1C2=CC=CC=C2N=C1N3CCC[C@@H](C3)C(=O)O

InChI

InChI=1S/C15H19N3O2/c1-2-18-13-8-4-3-7-12(13)16-15(18)17-9-5-6-11(10-17)14(19)20/h3-4,7-8,11H,2,5-6,9-10H2,1H3,(H,19,20)/t11-/m0/s1