4-(2-phenacyl-1,2,3,4-tetrazol-5-yl)-4-phenyl-piperidine-1-carboxylic acid

Systemtic Name: 4-(2-phenacyl-1,2,3,4-tetrazol-5-yl)-4-phenyl-piperidine-1-carboxylic acid Openeye Name: 4-(2-phenacyltetrazol-5-yl)-4-phenyl-piperidine-1-carboxylic acid CAS Name: 4-(2-phenacyl-5-tetrazolyl)-4-phenyl-1-piperidinecarboxylic acid IUPAC Name: 4-(2-phenacyltetrazol-5-yl)-4-phenylpiperidine-1-carboxylic acid Traditional Name: 4-(2-phenacyltetrazol-5-yl)-4-phenyl-piperidine-1-carboxylic acid Formula: C21H21N5O3 MolecularWeight: 391.42314

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1(C2=CC=CC=C2)C3=NN(N=N3)CC(=O)C4=CC=CC=C4)C(=O)O

Isomeric SMILES

C1CN(CCC1(C2=CC=CC=C2)C3=NN(N=N3)CC(=O)C4=CC=CC=C4)C(=O)O

InChI

InChI=1S/C21H21N5O3/c27-18(16-7-3-1-4-8-16)15-26-23-19(22-24-26)21(17-9-5-2-6-10-17)11-13-25(14-12-21)20(28)29/h1-10H,11-15H2,(H,28,29)