ethyl 1-[3-methoxy-4-(1,2,3,4-tetrazol-1-yl)phenyl]sulfonylpiperidine-3-carboxylate

Systemtic Name: ethyl 1-[3-methoxy-4-(1,2,3,4-tetrazol-1-yl)phenyl]sulfonylpiperidine-3-carboxylate Openeye Name: ethyl 1-[3-methoxy-4-(tetrazol-1-yl)phenyl]sulfonylpiperidine-3-carboxylate CAS Name: 1-[3-methoxy-4-(1-tetrazolyl)phenyl]sulfonyl-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[3-methoxy-4-(tetrazol-1-yl)phenyl]sulfonylpiperidine-3-carboxylate Traditional Name: 1-[3-methoxy-4-(tetrazol-1-yl)phenyl]sulfonylnipecotic acid ethyl ester Formula: C16H21N5O5S MolecularWeight: 395.43344

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)S(=O)(=O)C2=CC(=C(C=C2)N3C=NN=N3)OC

Isomeric SMILES

CCOC(=O)C1CCCN(C1)S(=O)(=O)C2=CC(=C(C=C2)N3C=NN=N3)OC

InChI

InChI=1S/C16H21N5O5S/c1-3-26-16(22)12-5-4-8-20(10-12)27(23,24)13-6-7-14(15(9-13)25-2)21-11-17-18-19-21/h6-7,9,11-12H,3-5,8,10H2,1-2H3