1-(6-ethoxy-1,3-benzothiazol-2-yl)piperidine-3-carboxylic acid

Systemtic Name: 1-(6-ethoxy-1,3-benzothiazol-2-yl)piperidine-3-carboxylic acid Openeye Name: 1-(6-ethoxy-1,3-benzothiazol-2-yl)piperidine-3-carboxylic acid CAS Name: 1-(6-ethoxy-1,3-benzothiazol-2-yl)-3-piperidinecarboxylic acid IUPAC Name: 1-(6-ethoxy-1,3-benzothiazol-2-yl)piperidine-3-carboxylic acid Traditional Name: 1-(6-ethoxy-1,3-benzothiazol-2-yl)nipecotic acid Formula: C15H18N2O3S MolecularWeight: 306.38002

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N=C(S2)N3CCCC(C3)C(=O)O

Isomeric SMILES

CCOC1=CC2=C(C=C1)N=C(S2)N3CCCC(C3)C(=O)O

InChI

InChI=1S/C15H18N2O3S/c1-2-20-11-5-6-12-13(8-11)21-15(16-12)17-7-3-4-10(9-17)14(18)19/h5-6,8,10H,2-4,7,9H2,1H3,(H,18,19)