1-(1-propan-2-ylbenzotriazol-5-yl)carbonylpiperidine-4-carboxylic acid

Systemtic Name: 1-(1-propan-2-ylbenzotriazol-5-yl)carbonylpiperidine-4-carboxylic acid Openeye Name: 1-(1-isopropylbenzotriazole-5-carbonyl)piperidine-4-carboxylic acid CAS Name: 1-[oxo-(1-propan-2-yl-5-benzotriazolyl)methyl]-4-piperidinecarboxylic acid IUPAC Name: 1-(1-propan-2-ylbenzotriazole-5-carbonyl)piperidine-4-carboxylic acid Traditional Name: 1-(1-isopropylbenzotriazole-5-carbonyl)isonipecotic acid Formula: C16H20N4O3 MolecularWeight: 316.355

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C2=C(C=C(C=C2)C(=O)N3CCC(CC3)C(=O)O)N=N1

Isomeric SMILES

CC(C)N1C2=C(C=C(C=C2)C(=O)N3CCC(CC3)C(=O)O)N=N1

InChI

InChI=1S/C16H20N4O3/c1-10(2)20-14-4-3-12(9-13(14)17-18-20)15(21)19-7-5-11(6-8-19)16(22)23/h3-4,9-11H,5-8H2,1-2H3,(H,22,23)