3-[[4-(1,3-benzothiazol-2-yl)piperidin-1-yl]carbonylamino]propanoic acid

Systemtic Name: 3-[[4-(1,3-benzothiazol-2-yl)piperidin-1-yl]carbonylamino]propanoic acid Openeye Name: 3-[[4-(1,3-benzothiazol-2-yl)piperidine-1-carbonyl]amino]propanoic acid CAS Name: 3-[[[4-(1,3-benzothiazol-2-yl)-1-piperidinyl]-oxomethyl]amino]propanoic acid IUPAC Name: 3-[[4-(1,3-benzothiazol-2-yl)piperidine-1-carbonyl]amino]propanoic acid Traditional Name: 3-[[4-(1,3-benzothiazol-2-yl)piperidine-1-carbonyl]amino]propionic acid Formula: C16H19N3O3S MolecularWeight: 333.40536

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C2=NC3=CC=CC=C3S2)C(=O)NCCC(=O)O

Isomeric SMILES

C1CN(CCC1C2=NC3=CC=CC=C3S2)C(=O)NCCC(=O)O

InChI

InChI=1S/C16H19N3O3S/c20-14(21)5-8-17-16(22)19-9-6-11(7-10-19)15-18-12-3-1-2-4-13(12)23-15/h1-4,11H,5-10H2,(H,17,22)(H,20,21)